Product OPENEYE NAME: [2-(2-benzylanilino)-2-oxo-ethyl] 2-norbornan-2-ylacetate
CAS Name: 2-(3-bicyclo[2.2.1]heptanyl)acetic acid [2-oxo-2-[2-(phenylmethyl)anilino]ethyl] ester
IUPAC NAME: [2-(2-benzylanilino)-2-oxoethyl] 2-(3-bicyclo[2.2.1]heptanyl)acetate
SYSTEMATIC NAME: [2-oxidanylidene-2-[[2-(phenylmethyl)phenyl]amino]ethyl] 2-(3-bicyclo[2.2.1]heptanyl)ethanoate
MOLECULAR FORMULA: C24H27NO3
MOLECULAR WEIGHT: 377.47608
SMILES: C1CC2CC1CC2CC(=O)OCC(=O)NC3=CC=CC=C3CC4=CC=CC=C4
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Product OPENEYE NAME: 4-bromo-N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]quinoxalin-2-yl]benzenesulfonamide
CAS Name: 4-bromo-N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-quinoxalinyl]benzenesulfonamide
IUPAC NAME: 4-bromo-N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]quinoxalin-2-yl]benzenesulfonamide
SYSTEMATIC NAME: 4-bromanyl-N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]quinoxalin-2-yl]benzenesulfonamide
MOLECULAR FORMULA: C24H23BrN4O4S
MOLECULAR WEIGHT: 543.43282
SMILES: COC1=C(C=C(C=C1)CCNC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)Br)OC
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Product OPENEYE NAME: 5-[benzyl(methyl)sulfamoyl]-N-(2-ethoxyphenyl)-2-fluoro-benzamide
CAS Name: N-(2-ethoxyphenyl)-2-fluoro-5-[methyl-(phenylmethyl)sulfamoyl]benzamide
IUPAC NAME: 5-[benzyl(methyl)sulfamoyl]-N-(2-ethoxyphenyl)-2-fluorobenzamide
SYSTEMATIC NAME: N-(2-ethoxyphenyl)-2-fluoranyl-5-[methyl-(phenylmethyl)sulfamoyl]benzamide
MOLECULAR FORMULA: C23H23FN2O4S
MOLECULAR WEIGHT: 442.503123
SMILES: CCOC1=CC=CC=C1NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N(C)CC3=CC=CC=C3)F
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Product OPENEYE NAME: [3-[[(3-fluorophenyl)carbamoyl-isopropyl-amino]methyl]phenyl] 4-fluorobenzenesulfonate
CAS Name: 4-fluorobenzenesulfonic acid [3-[[[(3-fluoroanilino)-oxomethyl]-propan-2-ylamino]methyl]phenyl] ester
IUPAC NAME: [3-[[(3-fluorophenyl)carbamoyl-propan-2-ylamino]methyl]phenyl] 4-fluorobenzenesulfonate
SYSTEMATIC NAME: [3-[[(3-fluorophenyl)carbamoyl-propan-2-yl-amino]methyl]phenyl] 4-fluoranylbenzenesulfonate
MOLECULAR FORMULA: C23H22F2N2O4S
MOLECULAR WEIGHT: 460.493586
SMILES: CC(C)N(CC1=CC(=CC=C1)OS(=O)(=O)C2=CC=C(C=C2)F)C(=O)NC3=CC(=CC=C3)F
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Product OPENEYE NAME: [5-[[(4-chlorophenyl)carbamoyl-sec-butyl-amino]methyl]-2-methoxy-phenyl] ethanesulfonate
CAS Name: ethanesulfonic acid [5-[[butan-2-yl-[(4-chloroanilino)-oxomethyl]amino]methyl]-2-methoxyphenyl] ester
IUPAC NAME: [5-[[butan-2-yl-[(4-chlorophenyl)carbamoyl]amino]methyl]-2-methoxyphenyl] ethanesulfonate
SYSTEMATIC NAME: [5-[[butan-2-yl-[(4-chlorophenyl)carbamoyl]amino]methyl]-2-methoxy-phenyl] ethanesulfonate
MOLECULAR FORMULA: C21H27ClN2O5S
MOLECULAR WEIGHT: 454.96748
SMILES: CCC(C)N(CC1=CC(=C(C=C1)OC)OS(=O)(=O)CC)C(=O)NC2=CC=C(C=C2)Cl
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Product OPENEYE NAME: N-[2-[1,3-benzodioxol-5-ylmethyl(2-thienylmethyl)amino]-2-oxo-ethyl]-4-butyl-N-(tetrahydrofuran-2-ylmethyl)benzamide
CAS Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-4-butyl-N-(2-oxolanylmethyl)benzamide
IUPAC NAME: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-4-butyl-N-(oxolan-2-ylmethyl)benzamide
SYSTEMATIC NAME: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-4-butyl-N-(oxolan-2-ylmethyl)benzamide
MOLECULAR FORMULA: C31H36N2O5S
MOLECULAR WEIGHT: 548.69294
SMILES: CCCCC1=CC=C(C=C1)C(=O)N(CC2CCCO2)CC(=O)N(CC3=CC4=C(C=C3)OCO4)CC5=CC=CS5
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Product OPENEYE NAME: 2,4,5,6-tetrafluorobenzene-1,3-dicarboxamidine
CAS Name: 2,4,5,6-tetrafluorobenzene-1,3-dicarboximidamide
IUPAC NAME: 2,4,5,6-tetrafluorobenzene-1,3-dicarboximidamide
SYSTEMATIC NAME: 2,4,5,6-tetrakis(fluoranyl)benzene-1,3-dicarboximidamide
MOLECULAR FORMULA: C8H6F4N4
MOLECULAR WEIGHT: 234.153653
SMILES: C1(=C(C(=C(C(=C1F)F)F)C(=N)N)F)C(=N)N
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Product OPENEYE NAME: 2-[[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl-(2-pyrrolidin-1-ylethyl)amino]methyl]benzonitrile
CAS Name: 2-[[[1-[(3-methoxyphenyl)methyl]-2-pyrrolyl]methyl-[2-(1-pyrrolidinyl)ethyl]amino]methyl]benzonitrile
IUPAC NAME: 2-[[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl-(2-pyrrolidin-1-ylethyl)amino]methyl]benzonitrile
SYSTEMATIC NAME: 2-[[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl-(2-pyrrolidin-1-ylethyl)amino]methyl]benzenecarbonitrile
MOLECULAR FORMULA: C27H32N4O
MOLECULAR WEIGHT: 428.56918
SMILES: COC1=CC=CC(=C1)CN2C=CC=C2CN(CCN3CCCC3)CC4=CC=CC=C4C#N
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Product OPENEYE NAME: 2-[2-[2-[[1-(hydroxymethyl)cyclopentyl]amino]-2-oxo-ethyl]pent-4-enoylamino]propyl hex-5-enoate
CAS Name: 5-hexenoic acid 2-[[2-[2-[[1-(hydroxymethyl)cyclopentyl]amino]-2-oxoethyl]-1-oxopent-4-enyl]amino]propyl ester
IUPAC NAME: 2-[2-[2-[[1-(hydroxymethyl)cyclopentyl]amino]-2-oxoethyl]pent-4-enoylamino]propyl hex-5-enoate
SYSTEMATIC NAME: 2-[2-[2-[[1-(hydroxymethyl)cyclopentyl]amino]-2-oxidanylidene-ethyl]pent-4-enoylamino]propyl hex-5-enoate
MOLECULAR FORMULA: C22H36N2O5
MOLECULAR WEIGHT: 408.53164
SMILES: CC(COC(=O)CCCC=C)NC(=O)C(CC=C)CC(=O)NC1(CCCC1)CO
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Product OPENEYE NAME: [2-[2-[2-[(2-hydroxy-1-methyl-ethyl)amino]-2-oxo-ethyl]pent-4-enoylamino]-1-methyl-ethyl] 2-(9H-fluoren-9-ylmethoxycarbonylamino)hex-5-enoate
CAS Name: 2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-5-hexenoic acid 1-[[2-[2-(1-hydroxypropan-2-ylamino)-2-oxoethyl]-1-oxopent-4-enyl]amino]propan-2-yl ester
IUPAC NAME: 1-[2-[2-(1-hydroxypropan-2-ylamino)-2-oxoethyl]pent-4-enoylamino]propan-2-yl 2-(9H-fluoren-9-ylmethoxycarbonylamino)hex-5-enoate
SYSTEMATIC NAME: 1-[2-[2-oxidanylidene-2-(1-oxidanylpropan-2-ylamino)ethyl]pent-4-enoylamino]propan-2-yl 2-(9H-fluoren-9-ylmethoxycarbonylamino)hex-5-enoate
MOLECULAR FORMULA: C34H43N3O7
MOLECULAR WEIGHT: 605.72112
SMILES: CC(CNC(=O)C(CC=C)CC(=O)NC(C)CO)OC(=O)C(CCC=C)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
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Product OPENEYE NAME: 2-(3-tert-butyl-5,12-dioxo-1-oxa-4-azacyclododec-8-en-6-yl)-N-[1-(hydroxymethyl)cyclopentyl]acetamide
CAS Name: 2-(3-tert-butyl-5,12-dioxo-1-oxa-4-azacyclododec-8-en-6-yl)-N-[1-(hydroxymethyl)cyclopentyl]acetamide
IUPAC NAME: 2-(3-tert-butyl-5,12-dioxo-1-oxa-4-azacyclododec-8-en-6-yl)-N-[1-(hydroxymethyl)cyclopentyl]acetamide
SYSTEMATIC NAME: 2-[3-tert-butyl-5,12-bis(oxidanylidene)-1-oxa-4-azacyclododec-8-en-6-yl]-N-[1-(hydroxymethyl)cyclopentyl]ethanamide
MOLECULAR FORMULA: C22H36N2O5
MOLECULAR WEIGHT: 408.53164
SMILES: CC(C)(C)C1COC(=O)CCC=CCC(C(=O)N1)CC(=O)NC2(CCCC2)CO
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Product OPENEYE NAME: benzyl 12-benzyl-6-[2-[3-(hydroxymethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxo-ethyl]-5,13-dioxo-1-oxa-4-azacyclotridec-8-ene-3-carboxylate
CAS Name: 6-[2-[3-(hydroxymethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxoethyl]-5,13-dioxo-12-(phenylmethyl)-1-oxa-4-azacyclotridec-8-ene-3-carboxylic acid (phenylmethyl) ester
IUPAC NAME: benzyl 12-benzyl-6-[2-[3-(hydroxymethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxoethyl]-5,13-dioxo-1-oxa-4-azacyclotridec-8-ene-3-carboxylate
SYSTEMATIC NAME: (phenylmethyl) 6-[2-[3-(hydroxymethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxidanylidene-ethyl]-5,13-bis(oxidanylidene)-12-(phenylmethyl)-1-oxa-4-azacyclotridec-8-ene-3-carboxylate
MOLECULAR FORMULA: C38H42N2O7
MOLECULAR WEIGHT: 638.74928
SMILES: C1CC(C(=O)OCC(NC(=O)C(CC=C1)CC(=O)N2CC3=CC=CC=C3CC2CO)C(=O)OCC4=CC=CC=C4)CC5=CC=CC=C5
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Product OPENEYE NAME: 2-(bromomethyl)-3a,7a-dichloro-4-(3-hydroxyphenyl)-5-vinyl-4,7-dihydroisoindole-1,3-dione
CAS Name: 2-(bromomethyl)-3a,7a-dichloro-5-ethenyl-4-(3-hydroxyphenyl)-4,7-dihydroisoindole-1,3-dione
IUPAC NAME: 2-(bromomethyl)-3a,7a-dichloro-5-ethenyl-4-(3-hydroxyphenyl)-4,7-dihydroisoindole-1,3-dione
SYSTEMATIC NAME: 2-(bromomethyl)-3a,7a-bis(chloranyl)-5-ethenyl-4-(3-hydroxyphenyl)-4,7-dihydroisoindole-1,3-dione
MOLECULAR FORMULA: C17H14BrCl2NO3
MOLECULAR WEIGHT: 431.10796
SMILES: C=CC1=CCC2(C(=O)N(C(=O)C2(C1C3=CC(=CC=C3)O)Cl)CBr)Cl
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Product OPENEYE NAME: 8-[5-(hydroxymethyl)-2-furyl]-2,3,8a-trimethyl-7-vinyl-5,8-dihydro-4aH-naphthalene-1,4-dione
CAS Name: 7-ethenyl-8-[5-(hydroxymethyl)-2-furanyl]-2,3,8a-trimethyl-5,8-dihydro-4aH-naphthalene-1,4-dione
IUPAC NAME: 7-ethenyl-8-[5-(hydroxymethyl)furan-2-yl]-2,3,8a-trimethyl-5,8-dihydro-4aH-naphthalene-1,4-dione
SYSTEMATIC NAME: 7-ethenyl-8-[5-(hydroxymethyl)furan-2-yl]-2,3,8a-trimethyl-5,8-dihydro-4aH-naphthalene-1,4-dione
MOLECULAR FORMULA: C20H22O4
MOLECULAR WEIGHT: 326.38628
SMILES: CC1=C(C(=O)C2(C(C1=O)CC=C(C2C3=CC=C(O3)CO)C=C)C)C
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Product OPENEYE NAME: 3-[6-(3-allyl-2-hydroxy-phenyl)-8-(2-carboxyethyl)-1,3,7,9-tetraoxo-3a,4,6,6a,9a,10,10a,10b-octahydroisoindolo[5,6-e]isoindol-2-yl]propanoic acid
CAS Name: 3-[8-(2-carboxyethyl)-6-(2-hydroxy-3-prop-2-enylphenyl)-1,3,7,9-tetraoxo-3a,4,6,6a,9a,10,10a,10b-octahydroisoindolo[5,6-e]isoindol-2-yl]propanoic acid
IUPAC NAME: 3-[8-(2-carboxyethyl)-6-(2-hydroxy-3-prop-2-enylphenyl)-1,3,7,9-tetraoxo-3a,4,6,6a,9a,10,10a,10b-octahydroisoindolo[5,6-e]isoindol-2-yl]propanoic acid
SYSTEMATIC NAME: 3-[8-(3-hydroxy-3-oxopropyl)-1,3,7,9-tetrakis(oxidanylidene)-6-(2-oxidanyl-3-prop-2-enyl-phenyl)-3a,4,6,6a,9a,10,10a,10b-octahydroisoindolo[5,6-e]isoindol-2-yl]propanoic acid
MOLECULAR FORMULA: C29H30N2O9
MOLECULAR WEIGHT: 550.5565
SMILES: C=CCC1=CC=CC(=C1O)C2C3C(CC4C2=CCC5C4C(=O)N(C5=O)CCC(=O)O)C(=O)N(C3=O)CCC(=O)O
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