Product OPENEYE NAME: [2-[4-[4-[[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]methyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]anilino]-1-methyl-2-oxo-ethyl] acetate
CAS Name: acetic acid [1-[4-[4-[[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]methyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]anilino]-1-oxopropan-2-yl] ester
IUPAC NAME: [1-[4-[4-[[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]methyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]anilino]-1-oxopropan-2-yl] acetate
SYSTEMATIC NAME: [1-[[4-[4-[[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]methyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]phenyl]amino]-1-oxidanylidene-propan-2-yl] ethanoate
MOLECULAR FORMULA: C34H39ClN2O7
MOLECULAR WEIGHT: 623.13566
SMILES: CC(C(=O)NC1=CC=C(C=C1)C2OC(CC(O2)C3=CC=C(C=C3)CO)CN4CCC(CC4)(C5=CC=C(C=C5)Cl)O)OC(=O)C
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Product OPENEYE NAME: 1-(4-benzyl-2-oxo-oxazolidin-3-yl)-3-[5-(10-hydroxydecyl)-4-(m-tolyl)-2-furyl]-2-methyl-propane-1,3-dione
CAS Name: 1-[5-(10-hydroxydecyl)-4-(3-methylphenyl)-2-furanyl]-2-methyl-3-[2-oxo-4-(phenylmethyl)-3-oxazolidinyl]propane-1,3-dione
IUPAC NAME: 1-(4-benzyl-2-oxo-1,3-oxazolidin-3-yl)-3-[5-(10-hydroxydecyl)-4-(3-methylphenyl)furan-2-yl]-2-methylpropane-1,3-dione
SYSTEMATIC NAME: 2-methyl-1-[4-(3-methylphenyl)-5-(10-oxidanyldecyl)furan-2-yl]-3-[2-oxidanylidene-4-(phenylmethyl)-1,3-oxazolidin-3-yl]propane-1,3-dione
MOLECULAR FORMULA: C35H43NO6
MOLECULAR WEIGHT: 573.71902
SMILES: CC1=CC=CC(=C1)C2=C(OC(=C2)C(=O)C(C)C(=O)N3C(COC3=O)CC4=CC=CC=C4)CCCCCCCCCCO
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Product OPENEYE NAME: [6-[[1-benzyl-2-[[4-tert-butoxy-1-(hydroxymethyl)-4-oxo-butyl]amino]-2-oxo-ethyl]-methyl-carbamoyl]spiro[3a,4,5,7a-tetrahydro-1,3-benzodioxole-2,2'-indane]-4-yl] 2-[2-(2-hydroxyethoxy)vinyl]benzoate
CAS Name: 2-[2-(2-hydroxyethoxy)ethenyl]benzoic acid [6'-[[[1-[[1-hydroxy-5-[(2-methylpropan-2-yl)oxy]-5-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-methylamino]-oxomethyl]-4'-spiro[1,3-dihydroindene-2,2'-3a,4,5,7a-tetrahydro-1,3-benzodioxole]yl] ester
IUPAC NAME: [6'-[[1-[[1-hydroxy-5-[(2-methylpropan-2-yl)oxy]-5-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-methylcarbamoyl]spiro[1,3-dihydroindene-2,2'-3a,4,5,7a-tetrahydro-1,3-benzodioxole]-4'-yl] 2-[2-(2-hydroxyethoxy)ethenyl]benzoate
SYSTEMATIC NAME: [6'-[methyl-[1-[[5-[(2-methylpropan-2-yl)oxy]-1-oxidanyl-5-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]spiro[1,3-dihydroindene-2,2'-3a,4,5,7a-tetrahydro-1,3-benzodioxole]-4'-yl] 2-[2-(2-hydroxyethyloxy)ethenyl]benzoate
MOLECULAR FORMULA: C46H54N2O11
MOLECULAR WEIGHT: 810.92776
SMILES: CC(C)(C)OC(=O)CCC(CO)NC(=O)C(CC1=CC=CC=C1)N(C)C(=O)C2=CC3C(C(C2)OC(=O)C4=CC=CC=C4C=COCCO)OC5(O3)CC6=CC=CC=C6C5
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Product OPENEYE NAME: [6-[[3-[[4-tert-butoxy-1-(hydroxymethyl)-4-oxo-butyl]carbamoyl]phenyl]methylcarbamoyl]-2,2-diphenyl-3a,4,5,7a-tetrahydro-1,3-benzodioxol-4-yl] 4-[3-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxyprop-1-enyl]benzoate
CAS Name: 4-[3-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]prop-1-enyl]benzoic acid [6-[[[3-[[[1-hydroxy-5-[(2-methylpropan-2-yl)oxy]-5-oxopentan-2-yl]amino]-oxomethyl]phenyl]methylamino]-oxomethyl]-2,2-diphenyl-3a,4,5,7a-tetrahydro-1,3-benzodioxol-4-yl] este
IUPAC NAME: [6-[[3-[[1-hydroxy-5-[(2-methylpropan-2-yl)oxy]-5-oxopentan-2-yl]carbamoyl]phenyl]methylcarbamoyl]-2,2-diphenyl-3a,4,5,7a-tetrahydro-1,3-benzodioxol-4-yl] 4-[3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyprop-1-enyl]benzoate
SYSTEMATIC NAME: [6-[[3-[[5-[(2-methylpropan-2-yl)oxy]-1-oxidanyl-5-oxidanylidene-pentan-2-yl]carbamoyl]phenyl]methylcarbamoyl]-2,2-diphenyl-3a,4,5,7a-tetrahydro-1,3-benzodioxol-4-yl] 4-[3-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxyprop-1-enyl]benzoate
MOLECULAR FORMULA: C53H60N2O15
MOLECULAR WEIGHT: 965.0479
SMILES: CC(C)(C)OC(=O)CCC(CO)NC(=O)C1=CC(=CC=C1)CNC(=O)C2=CC3C(C(C2)OC(=O)C4=CC=C(C=C4)C=CCOC5C(C(C(C(O5)CO)O)O)O)OC(O3)(C6=CC=CC=C6)C7=CC=CC=C7
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MOLECULAR FORMULA: C39H58IN3O10
MOLECULAR WEIGHT: 855.79639
SMILES: CCCCCC1(OC2C3CC4(C(C2O1)ON(C4C(=O)O3)CC5=CC(=CC=C5)I)C(=O)NCCC(=O)NC(CCC(=O)OC(C)(C)C)CO)CCCCC
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MOLECULAR FORMULA: C35H44F3N3O13
MOLECULAR WEIGHT: 771.73137
SMILES: CC(C(C(=O)NC(CCC(=O)OC(C)(C)C)CO)NC(=O)C12CC3C4C(C1ON(C2C(=O)O3)CC5=CC=CC(=C5)C=CC(=O)OCC(F)(F)F)OCO4)O
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MOLECULAR FORMULA: C46H52N2O8
MOLECULAR WEIGHT: 760.91368
SMILES: CC1(CC2C1CCC3(C(O3)CCC2=CC4=CC=CC=C4CN5C6C(=O)OC7CC6(C(O5)C8C7OC(O8)(C9=CC=CC=C9)C1=CC=CC=C1)C(=O)NCCO)C)C
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Product OPENEYE NAME: 5-[3-ethoxypropyl(hept-6-enoyl)amino]-4-hydroxy-N-(2-hydroxyethyl)-3-(2-iodophenoxy)cyclohexene-1-carboxamide
CAS Name: 5-[3-ethoxypropyl(1-oxohept-6-enyl)amino]-4-hydroxy-N-(2-hydroxyethyl)-3-(2-iodophenoxy)-1-cyclohexenecarboxamide
IUPAC NAME: 5-[3-ethoxypropyl(hept-6-enoyl)amino]-4-hydroxy-N-(2-hydroxyethyl)-3-(2-iodophenoxy)cyclohexene-1-carboxamide
SYSTEMATIC NAME: 5-[3-ethoxypropyl(hept-6-enoyl)amino]-N-(2-hydroxyethyl)-3-(2-iodanylphenoxy)-4-oxidanyl-cyclohexene-1-carboxamide
MOLECULAR FORMULA: C27H39IN2O6
MOLECULAR WEIGHT: 614.51283
SMILES: CCOCCCN(C1CC(=CC(C1O)OC2=CC=CC=C2I)C(=O)NCCO)C(=O)CCCCC=C
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Product OPENEYE NAME: N-[6-hydroxy-3-(2-hydroxyethylcarbamoyl)-5-(2-iodophenoxy)cyclohex-3-en-1-yl]-7-methoxy-N-[2-(3-methoxyphenyl)ethyl]benzofuran-2-carboxamide
CAS Name: N-[6-hydroxy-3-[(2-hydroxyethylamino)-oxomethyl]-5-(2-iodophenoxy)-1-cyclohex-3-enyl]-7-methoxy-N-[2-(3-methoxyphenyl)ethyl]-2-benzofurancarboxamide
IUPAC NAME: N-[6-hydroxy-3-(2-hydroxyethylcarbamoyl)-5-(2-iodophenoxy)cyclohex-3-en-1-yl]-7-methoxy-N-[2-(3-methoxyphenyl)ethyl]-1-benzofuran-2-carboxamide
SYSTEMATIC NAME: N-[3-(2-hydroxyethylcarbamoyl)-5-(2-iodanylphenoxy)-6-oxidanyl-cyclohex-3-en-1-yl]-7-methoxy-N-[2-(3-methoxyphenyl)ethyl]-1-benzofuran-2-carboxamide
MOLECULAR FORMULA: C34H35IN2O8
MOLECULAR WEIGHT: 726.55477
SMILES: COC1=CC=CC(=C1)CCN(C2CC(=CC(C2O)OC3=CC=CC=C3I)C(=O)NCCO)C(=O)C4=CC5=C(O4)C(=CC=C5)OC
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Product OPENEYE NAME: 3-[benzyl-(2-methoxyacetyl)amino]-4-hydroxy-N-(2-hydroxyethyl)-3,4,4a,9b-tetrahydrodibenzofuran-1-carboxamide
CAS Name: 4-hydroxy-N-(2-hydroxyethyl)-3-[(2-methoxy-1-oxoethyl)-(phenylmethyl)amino]-3,4,4a,9b-tetrahydrodibenzofuran-1-carboxamide
IUPAC NAME: 3-[benzyl-(2-methoxyacetyl)amino]-4-hydroxy-N-(2-hydroxyethyl)-3,4,4a,9b-tetrahydrodibenzofuran-1-carboxamide
SYSTEMATIC NAME: N-(2-hydroxyethyl)-3-[2-methoxyethanoyl-(phenylmethyl)amino]-4-oxidanyl-3,4,4a,9b-tetrahydrodibenzofuran-1-carboxamide
MOLECULAR FORMULA: C25H28N2O6
MOLECULAR WEIGHT: 452.49962
SMILES: COCC(=O)N(CC1=CC=CC=C1)C2C=C(C3C(C2O)OC4=CC=CC=C34)C(=O)NCCO
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Product OPENEYE NAME: 5-[cyclopentyl(3-cyclopentylpropanoyl)amino]-3-(4-formyl-2-iodo-6-methoxy-phenoxy)-4-hydroxy-N-(2-hydroxyethyl)cyclohexene-1-carboxamide
CAS Name: 5-[cyclopentyl-(3-cyclopentyl-1-oxopropyl)amino]-3-(4-formyl-2-iodo-6-methoxyphenoxy)-4-hydroxy-N-(2-hydroxyethyl)-1-cyclohexenecarboxamide
IUPAC NAME: 5-[cyclopentyl(3-cyclopentylpropanoyl)amino]-3-(4-formyl-2-iodo-6-methoxyphenoxy)-4-hydroxy-N-(2-hydroxyethyl)cyclohexene-1-carboxamide
SYSTEMATIC NAME: 5-[cyclopentyl(3-cyclopentylpropanoyl)amino]-N-(2-hydroxyethyl)-3-(2-iodanyl-4-methanoyl-6-methoxy-phenoxy)-4-oxidanyl-cyclohexene-1-carboxamide
MOLECULAR FORMULA: C30H41IN2O7
MOLECULAR WEIGHT: 668.56021
SMILES: COC1=C(C(=CC(=C1)C=O)I)OC2C=C(CC(C2O)N(C3CCCC3)C(=O)CCC4CCCC4)C(=O)NCCO
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Product OPENEYE NAME: [3-[[isobutyl(m-tolylcarbamoyl)amino]methyl]phenyl] 4-fluorobenzenesulfonate
CAS Name: 4-fluorobenzenesulfonic acid [3-[[[(3-methylanilino)-oxomethyl]-(2-methylpropyl)amino]methyl]phenyl] ester
IUPAC NAME: [3-[[(3-methylphenyl)carbamoyl-(2-methylpropyl)amino]methyl]phenyl] 4-fluorobenzenesulfonate
SYSTEMATIC NAME: [3-[[(3-methylphenyl)carbamoyl-(2-methylpropyl)amino]methyl]phenyl] 4-fluoranylbenzenesulfonate
MOLECULAR FORMULA: C25H27FN2O4S
MOLECULAR WEIGHT: 470.556283
SMILES: CC1=CC(=CC=C1)NC(=O)N(CC2=CC(=CC=C2)OS(=O)(=O)C3=CC=C(C=C3)F)CC(C)C
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Product OPENEYE NAME: [5-[[(2-ethoxyphenyl)carbamoyl-(2-methoxyethyl)amino]methyl]-2-methoxy-phenyl] 4-fluorobenzenesulfonate
CAS Name: 4-fluorobenzenesulfonic acid [5-[[[(2-ethoxyanilino)-oxomethyl]-(2-methoxyethyl)amino]methyl]-2-methoxyphenyl] ester
IUPAC NAME: [5-[[(2-ethoxyphenyl)carbamoyl-(2-methoxyethyl)amino]methyl]-2-methoxyphenyl] 4-fluorobenzenesulfonate
SYSTEMATIC NAME: [5-[[(2-ethoxyphenyl)carbamoyl-(2-methoxyethyl)amino]methyl]-2-methoxy-phenyl] 4-fluoranylbenzenesulfonate
MOLECULAR FORMULA: C26H29FN2O7S
MOLECULAR WEIGHT: 532.581063
SMILES: CCOC1=CC=CC=C1NC(=O)N(CCOC)CC2=CC(=C(C=C2)OC)OS(=O)(=O)C3=CC=C(C=C3)F
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Product OPENEYE NAME: N-[2-[1,3-benzodioxol-5-ylmethyl(2-thienylmethyl)amino]-2-oxo-ethyl]-4-chloro-N-(3-methoxypropyl)benzamide
CAS Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-4-chloro-N-(3-methoxypropyl)benzamide
IUPAC NAME: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-4-chloro-N-(3-methoxypropyl)benzamide
SYSTEMATIC NAME: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-4-chloranyl-N-(3-methoxypropyl)benzamide
MOLECULAR FORMULA: C26H27ClN2O5S
MOLECULAR WEIGHT: 515.02098
SMILES: COCCCN(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)C(=O)C4=CC=C(C=C4)Cl
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Product OPENEYE NAME: N-[2-[(4-fluorophenyl)methyl-(2-thienylmethyl)amino]-2-oxo-ethyl]-N-sec-butyl-hexanamide
CAS Name: N-butan-2-yl-N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]hexanamide
IUPAC NAME: N-butan-2-yl-N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]hexanamide
SYSTEMATIC NAME: N-butan-2-yl-N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]hexanamide
MOLECULAR FORMULA: C24H33FN2O2S
MOLECULAR WEIGHT: 432.594423
SMILES: CCCCCC(=O)N(CC(=O)N(CC1=CC=C(C=C1)F)CC2=CC=CS2)C(C)CC
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Product OPENEYE NAME: methyl 4-[[2-[(3-methoxyphenyl)methylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl]amino]benzoate
CAS Name: 4-[[[2-[(3-methoxyphenyl)methylamino]-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]-oxomethyl]amino]benzoic acid methyl ester
IUPAC NAME: methyl 4-[[2-[(3-methoxyphenyl)methylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl]amino]benzoate
SYSTEMATIC NAME: methyl 4-[[2-[(3-methoxyphenyl)methylamino]-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]carbonylamino]benzoate
MOLECULAR FORMULA: C25H26N2O4S
MOLECULAR WEIGHT: 450.54994
SMILES: COC1=CC=CC(=C1)CNC2=C(C3=C(S2)CCCC3)C(=O)NC4=CC=C(C=C4)C(=O)OC
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Product OPENEYE NAME: 2-amino-1-(3-chloro-4-methyl-phenyl)-4-(2-ethylsulfanyl-5-methyl-3-furyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile
CAS Name: 2-amino-1-(3-chloro-4-methylphenyl)-4-[2-(ethylthio)-5-methyl-3-furanyl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile
IUPAC NAME: 2-amino-1-(3-chloro-4-methylphenyl)-4-(2-ethylsulfanyl-5-methylfuran-3-yl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile
SYSTEMATIC NAME: 2-azanyl-1-(3-chloranyl-4-methyl-phenyl)-4-(2-ethylsulfanyl-5-methyl-furan-3-yl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile
MOLECULAR FORMULA: C24H24ClN3O2S
MOLECULAR WEIGHT: 453.98426
SMILES: CCSC1=C(C=C(O1)C)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC(=C(C=C4)C)Cl)N)C#N
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Product OPENEYE NAME: 2-amino-4-[5-[(4-chloro-2-methyl-phenoxy)methyl]-2,4-dimethyl-phenyl]-5-oxo-1-(3-pyridyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
CAS Name: 2-amino-4-[5-[(4-chloro-2-methylphenoxy)methyl]-2,4-dimethylphenyl]-5-oxo-1-(3-pyridinyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
IUPAC NAME: 2-amino-4-[5-[(4-chloro-2-methylphenoxy)methyl]-2,4-dimethylphenyl]-5-oxo-1-pyridin-3-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile
SYSTEMATIC NAME: 2-azanyl-4-[5-[(4-chloranyl-2-methyl-phenoxy)methyl]-2,4-dimethyl-phenyl]-5-oxidanylidene-1-pyridin-3-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile
MOLECULAR FORMULA: C31H29ClN4O2
MOLECULAR WEIGHT: 525.04056
SMILES: CC1=CC(=C(C=C1C2C(=C(N(C3=C2C(=O)CCC3)C4=CN=CC=C4)N)C#N)COC5=C(C=C(C=C5)Cl)C)C
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Product OPENEYE NAME: 2-amino-1-(3-chloro-4-fluoro-phenyl)-4-[5-[(4-fluorophenyl)sulfanylmethyl]-2,4-dimethyl-phenyl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile
CAS Name: 2-amino-1-(3-chloro-4-fluorophenyl)-4-[5-[[(4-fluorophenyl)thio]methyl]-2,4-dimethylphenyl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile
IUPAC NAME: 2-amino-1-(3-chloro-4-fluorophenyl)-4-[5-[(4-fluorophenyl)sulfanylmethyl]-2,4-dimethylphenyl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile
SYSTEMATIC NAME: 2-azanyl-1-(3-chloranyl-4-fluoranyl-phenyl)-4-[5-[(4-fluorophenyl)sulfanylmethyl]-2,4-dimethyl-phenyl]-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile
MOLECULAR FORMULA: C31H26ClF2N3OS
MOLECULAR WEIGHT: 562.072446
SMILES: CC1=CC(=C(C=C1C2C(=C(N(C3=C2C(=O)CCC3)C4=CC(=C(C=C4)F)Cl)N)C#N)CSC5=CC=C(C=C5)F)C
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Product OPENEYE NAME: 2-amino-1-(3,5-dichlorophenyl)-4-[2,5-dimethyl-3-[(4-methylphenoxy)methyl]phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile
CAS Name: 2-amino-1-(3,5-dichlorophenyl)-4-[2,5-dimethyl-3-[(4-methylphenoxy)methyl]phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile
IUPAC NAME: 2-amino-1-(3,5-dichlorophenyl)-4-[2,5-dimethyl-3-[(4-methylphenoxy)methyl]phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile
SYSTEMATIC NAME: 2-azanyl-1-[3,5-bis(chloranyl)phenyl]-4-[2,5-dimethyl-3-[(4-methylphenoxy)methyl]phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile
MOLECULAR FORMULA: C34H33Cl2N3O2
MOLECULAR WEIGHT: 586.55072
SMILES: CC1=CC=C(C=C1)OCC2=C(C(=CC(=C2)C)C3C(=C(N(C4=C3C(=O)CC(C4)(C)C)C5=CC(=CC(=C5)Cl)Cl)N)C#N)C
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Product OPENEYE NAME: 2-amino-4-[5-(benzylsulfanylmethyl)-2,4-dimethyl-phenyl]-1-(4-chloro-2-nitro-phenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile
CAS Name: 2-amino-1-(4-chloro-2-nitrophenyl)-4-[2,4-dimethyl-5-[(phenylmethylthio)methyl]phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile
IUPAC NAME: 2-amino-4-[5-(benzylsulfanylmethyl)-2,4-dimethylphenyl]-1-(4-chloro-2-nitrophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile
SYSTEMATIC NAME: 2-azanyl-1-(4-chloranyl-2-nitro-phenyl)-4-[2,4-dimethyl-5-[(phenylmethylsulfanyl)methyl]phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile
MOLECULAR FORMULA: C34H33ClN4O3S
MOLECULAR WEIGHT: 613.16882
SMILES: CC1=CC(=C(C=C1C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=C(C=C(C=C4)Cl)[N+](=O)[O-])N)C#N)CSCC5=CC=CC=C5)C
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Product OPENEYE NAME: 2-amino-4-[3-[(2,5-dichlorophenyl)sulfanylmethyl]-2,5-dimethyl-phenyl]-1-(4-iodophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile
CAS Name: 2-amino-4-[3-[[(2,5-dichlorophenyl)thio]methyl]-2,5-dimethylphenyl]-1-(4-iodophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile
IUPAC NAME: 2-amino-4-[3-[(2,5-dichlorophenyl)sulfanylmethyl]-2,5-dimethylphenyl]-1-(4-iodophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile
SYSTEMATIC NAME: 2-azanyl-4-[3-[[2,5-bis(chloranyl)phenyl]sulfanylmethyl]-2,5-dimethyl-phenyl]-1-(4-iodophenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile
MOLECULAR FORMULA: C33H30Cl2IN3OS
MOLECULAR WEIGHT: 714.48627
SMILES: CC1=CC(=C(C(=C1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=CC=C(C=C4)I)N)C#N)C)CSC5=C(C=CC(=C5)Cl)Cl
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Product OPENEYE NAME: ethyl 2-[(4,5-dibromo-2-furyl)methylene]-5-(3-ethoxy-4-methoxy-phenyl)-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate
CAS Name: 2-[(4,5-dibromo-2-furanyl)methylidene]-5-(3-ethoxy-4-methoxyphenyl)-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester
IUPAC NAME: ethyl 2-[(4,5-dibromofuran-2-yl)methylidene]-5-(3-ethoxy-4-methoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 2-[[4,5-bis(bromanyl)furan-2-yl]methylidene]-5-(3-ethoxy-4-methoxy-phenyl)-7-methyl-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C24H22Br2N2O6S
MOLECULAR WEIGHT: 626.31428
SMILES: CCOC1=C(C=CC(=C1)C2C(=C(N=C3N2C(=O)C(=CC4=CC(=C(O4)Br)Br)S3)C)C(=O)OCC)OC
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Product OPENEYE NAME: 6-[[4-(4-isobutylphenyl)-5-methyl-thiazol-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
CAS Name: 6-[[[5-methyl-4-[4-(2-methylpropyl)phenyl]-2-thiazolyl]amino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid
IUPAC NAME: 6-[[5-methyl-4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
SYSTEMATIC NAME: 6-[[5-methyl-4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
MOLECULAR FORMULA: C22H26N2O3S
MOLECULAR WEIGHT: 398.51844
SMILES: CC1=C(N=C(S1)NC(=O)C2CC=CCC2C(=O)O)C3=CC=C(C=C3)CC(C)C
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