Product OPENEYE NAME: 4-(3-amino-4-methoxy-phenyl)-2-oxo-N,3-bis(3,4,5-trimethoxyphenyl)imidazole-1-carboxamide
CAS Name: 4-(3-amino-4-methoxyphenyl)-2-oxo-N,3-bis(3,4,5-trimethoxyphenyl)-1-imidazolecarboxamide
IUPAC NAME: 4-(3-amino-4-methoxyphenyl)-2-oxo-N,3-bis(3,4,5-trimethoxyphenyl)imidazole-1-carboxamide
SYSTEMATIC NAME: 4-(3-azanyl-4-methoxy-phenyl)-2-oxidanylidene-N,3-bis(3,4,5-trimethoxyphenyl)imidazole-1-carboxamide
MOLECULAR FORMULA: C29H32N4O9
MOLECULAR WEIGHT: 580.58578
SMILES: COC1=C(C=C(C=C1)C2=CN(C(=O)N2C3=CC(=C(C(=C3)OC)OC)OC)C(=O)NC4=CC(=C(C(=C4)OC)OC)OC)N
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Product OPENEYE NAME: [4-(3-propyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]-[(3S,5S)-5-(pyrrolidine-1-carbonyl)pyrrolidin-3-yl]methanone
CAS Name: [(3S,5S)-5-[oxo(1-pyrrolidinyl)methyl]-3-pyrrolidinyl]-[4-(3-propyl-1,2,4-thiadiazol-5-yl)-1-piperazinyl]methanone
IUPAC NAME: [4-(3-propyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]-[(3S,5S)-5-(pyrrolidine-1-carbonyl)pyrrolidin-3-yl]methanone
SYSTEMATIC NAME: [4-(3-propyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]-[(3S,5S)-5-pyrrolidin-1-ylcarbonylpyrrolidin-3-yl]methanone
MOLECULAR FORMULA: C19H30N6O2S
MOLECULAR WEIGHT: 406.5455
SMILES: CCCC1=NSC(=N1)N2CCN(CC2)C(=O)[C@H]3C[C@H](NC3)C(=O)N4CCCC4
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Product OPENEYE NAME: (4R)-5-chloro-4-methyl-1,4-dihydroquinazolin-2-amine
CAS Name: (4R)-5-chloro-4-methyl-1,4-dihydroquinazolin-2-amine
IUPAC NAME: (4R)-5-chloro-4-methyl-1,4-dihydroquinazolin-2-amine
SYSTEMATIC NAME: (4R)-5-chloranyl-4-methyl-1,4-dihydroquinazolin-2-amine
MOLECULAR FORMULA: C9H10ClN3
MOLECULAR WEIGHT: 195.6488
SMILES: C[C@@H]1C2=C(C=CC=C2Cl)NC(=N1)N
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Product OPENEYE NAME: N-cyclobutyl-4-methyl-1,4-dihydroquinazolin-2-amine
CAS Name: N-cyclobutyl-4-methyl-1,4-dihydroquinazolin-2-amine
IUPAC NAME: N-cyclobutyl-4-methyl-1,4-dihydroquinazolin-2-amine
SYSTEMATIC NAME: N-cyclobutyl-4-methyl-1,4-dihydroquinazolin-2-amine
MOLECULAR FORMULA: C13H17N3
MOLECULAR WEIGHT: 215.29418
SMILES: CC1C2=CC=CC=C2NC(=N1)NC3CCC3
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Product OPENEYE NAME: (2R)-2-(5-bromo-2-furyl)-2-[(2R,5R)-5-indan-2-yl-2-isobutyl-3,6-dioxo-piperazin-1-yl]-N-isopropyl-acetamide
CAS Name: (2R)-2-(5-bromo-2-furanyl)-2-[(2R,5R)-5-(2,3-dihydro-1H-inden-2-yl)-2-(2-methylpropyl)-3,6-dioxo-1-piperazinyl]-N-propan-2-ylacetamide
IUPAC NAME: (2R)-2-(5-bromofuran-2-yl)-2-[(2R,5R)-5-(2,3-dihydro-1H-inden-2-yl)-2-(2-methylpropyl)-3,6-dioxopiperazin-1-yl]-N-propan-2-ylacetamide
SYSTEMATIC NAME: (2R)-2-(5-bromanylfuran-2-yl)-2-[(2R,5R)-5-(2,3-dihydro-1H-inden-2-yl)-2-(2-methylpropyl)-3,6-bis(oxidanylidene)piperazin-1-yl]-N-propan-2-yl-ethanamide
MOLECULAR FORMULA: C26H32BrN3O4
MOLECULAR WEIGHT: 530.45398
SMILES: CC(C)C[C@@H]1C(=O)N[C@@H](C(=O)N1[C@H](C2=CC=C(O2)Br)C(=O)NC(C)C)C3CC4=CC=CC=C4C3
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MOLECULAR FORMULA: C17H23NO3
MOLECULAR WEIGHT: 289.36942
SMILES: C[C@H]1C2CC3=C([C@]1(CCN2CCC(=O)O)C)C=C(C=C3)O
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MOLECULAR FORMULA: C20H29NO3
MOLECULAR WEIGHT: 331.44916
SMILES: CCOC(=O)CCCN1CC[C@]2([C@H](C1CC3=C2C=C(C=C3)O)C)C
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MOLECULAR FORMULA: C19H27NO3
MOLECULAR WEIGHT: 317.42258
SMILES: CCOC(=O)CCN1CC[C@]2([C@H](C1CC3=C2C=C(C=C3)O)C)C
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MOLECULAR FORMULA: C16H21NO3
MOLECULAR WEIGHT: 275.34284
SMILES: C[C@H]1C2CC3=C([C@]1(CCN2CC(=O)O)C)C=C(C=C3)O
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Product OPENEYE NAME: 4-[2-[4-[(4-chlorophenyl)-(2-thienyl)methyl]phenoxy]ethyl]morpholine
CAS Name: 4-[2-[4-[(4-chlorophenyl)-thiophen-2-ylmethyl]phenoxy]ethyl]morpholine
IUPAC NAME: 4-[2-[4-[(4-chlorophenyl)-thiophen-2-ylmethyl]phenoxy]ethyl]morpholine
SYSTEMATIC NAME: 4-[2-[4-[(4-chlorophenyl)-thiophen-2-yl-methyl]phenoxy]ethyl]morpholine
MOLECULAR FORMULA: C23H24ClNO2S
MOLECULAR WEIGHT: 413.96016
SMILES: C1COCCN1CCOC2=CC=C(C=C2)C(C3=CC=C(C=C3)Cl)C4=CC=CS4
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Product OPENEYE NAME: 1-[2-[4-[(4-methylsulfanylphenyl)-(2-thienyl)methyl]phenoxy]ethyl]azepane
CAS Name: 1-[2-[4-[[4-(methylthio)phenyl]-thiophen-2-ylmethyl]phenoxy]ethyl]azepane
IUPAC NAME: 1-[2-[4-[(4-methylsulfanylphenyl)-thiophen-2-ylmethyl]phenoxy]ethyl]azepane
SYSTEMATIC NAME: 1-[2-[4-[(4-methylsulfanylphenyl)-thiophen-2-yl-methyl]phenoxy]ethyl]azepane
MOLECULAR FORMULA: C26H31NOS2
MOLECULAR WEIGHT: 437.66044
SMILES: CSC1=CC=C(C=C1)C(C2=CC=C(C=C2)OCCN3CCCCCC3)C4=CC=CS4
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Product OPENEYE NAME: 2-[4-[(4-chlorophenyl)-(2-thienyl)methyl]phenoxy]-N,N-dimethyl-ethanamine
CAS Name: 2-[4-[(4-chlorophenyl)-thiophen-2-ylmethyl]phenoxy]-N,N-dimethylethanamine
IUPAC NAME: 2-[4-[(4-chlorophenyl)-thiophen-2-ylmethyl]phenoxy]-N,N-dimethylethanamine
SYSTEMATIC NAME: 2-[4-[(4-chlorophenyl)-thiophen-2-yl-methyl]phenoxy]-N,N-dimethyl-ethanamine
MOLECULAR FORMULA: C21H22ClNOS
MOLECULAR WEIGHT: 371.92348
SMILES: CN(C)CCOC1=CC=C(C=C1)C(C2=CC=C(C=C2)Cl)C3=CC=CS3
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Product OPENEYE NAME: 5-chloro-N-[1-[4-[2-[(dimethylamino)methyl]imidazol-1-yl]-2-fluoro-phenyl]-2-oxo-pyrrolidin-3-yl]benzothiophene-2-sulfonamide
CAS Name: 5-chloro-N-[1-[4-[2-[(dimethylamino)methyl]-1-imidazolyl]-2-fluorophenyl]-2-oxo-3-pyrrolidinyl]-1-benzothiophene-2-sulfonamide
IUPAC NAME: 5-chloro-N-[1-[4-[2-[(dimethylamino)methyl]imidazol-1-yl]-2-fluorophenyl]-2-oxopyrrolidin-3-yl]-1-benzothiophene-2-sulfonamide
SYSTEMATIC NAME: 5-chloranyl-N-[1-[4-[2-[(dimethylamino)methyl]imidazol-1-yl]-2-fluoranyl-phenyl]-2-oxidanylidene-pyrrolidin-3-yl]-1-benzothiophene-2-sulfonamide
MOLECULAR FORMULA: C24H23ClFN5O3S2
MOLECULAR WEIGHT: 548.052523
SMILES: CN(C)CC1=NC=CN1C2=CC(=C(C=C2)N3CCC(C3=O)NS(=O)(=O)C4=CC5=C(S4)C=CC(=C5)Cl)F
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Product OPENEYE NAME: 5-chloro-4-ethyl-1,4-dihydroquinazolin-2-amine
CAS Name: 5-chloro-4-ethyl-1,4-dihydroquinazolin-2-amine
IUPAC NAME: 5-chloro-4-ethyl-1,4-dihydroquinazolin-2-amine
SYSTEMATIC NAME: 5-chloranyl-4-ethyl-1,4-dihydroquinazolin-2-amine
MOLECULAR FORMULA: C10H12ClN3
MOLECULAR WEIGHT: 209.67538
SMILES: CCC1C2=C(C=CC=C2Cl)NC(=N1)N
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Product OPENEYE NAME: tripotassium (2S)-2-[[3-[[(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl]oxy]propoxy-oxido-phosphoryl]amino]pentanedioate
CAS Name: tripotassium (2S)-2-[[3-[[(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl]oxy]propoxy-oxidophosphoryl]amino]pentanedioate
IUPAC NAME: tripotassium (2S)-2-[[3-[[(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl]oxy]propoxy-oxidophosphoryl]amino]pentanedioate
SYSTEMATIC NAME: tripotassium (2S)-2-[[3-[[(8R,9S,13S,14S)-13-methyl-17-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl]oxy]propoxy-oxidanidyl-phosphoryl]amino]pentanedioate
MOLECULAR FORMULA: C26H33K3NO9P
MOLECULAR WEIGHT: 651.810181
SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=C3C=CC(=C4)OCCCOP(=O)(N[C@@H](CCC(=O)[O-])C(=O)[O-])[O-].[K+].[K+].[K+]
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Product OPENEYE NAME: (2S)-2-[[hydroxy-[3-[[(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl]oxy]propoxy]phosphoryl]amino]pentanedioic acid
CAS Name: (2S)-2-[[hydroxy-[3-[[(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl]oxy]propoxy]phosphoryl]amino]pentanedioic acid
IUPAC NAME: (2S)-2-[[hydroxy-[3-[[(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl]oxy]propoxy]phosphoryl]amino]pentanedioic acid
SYSTEMATIC NAME: (2S)-2-[[3-[[(8R,9S,13S,14S)-13-methyl-17-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl]oxy]propoxy-oxidanyl-phosphoryl]amino]pentanedioic acid
MOLECULAR FORMULA: C26H36NO9P
MOLECULAR WEIGHT: 537.539101
SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=C3C=CC(=C4)OCCCOP(=O)(N[C@@H](CCC(=O)O)C(=O)O)O
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