Product OPENEYE NAME: N-[6-(3,5-dimethylpyrazol-1-yl)-2-(5-methyl-2-furyl)pyrimidin-4-yl]-2-(4-methoxyphenyl)acetamide
CAS Name: N-[6-(3,5-dimethyl-1-pyrazolyl)-2-(5-methyl-2-furanyl)-4-pyrimidinyl]-2-(4-methoxyphenyl)acetamide
IUPAC NAME: N-[6-(3,5-dimethylpyrazol-1-yl)-2-(5-methylfuran-2-yl)pyrimidin-4-yl]-2-(4-methoxyphenyl)acetamide
SYSTEMATIC NAME: N-[6-(3,5-dimethylpyrazol-1-yl)-2-(5-methylfuran-2-yl)pyrimidin-4-yl]-2-(4-methoxyphenyl)ethanamide
MOLECULAR FORMULA: C23H23N5O3
MOLECULAR WEIGHT: 417.46042
SMILES: CC1=CC=C(O1)C2=NC(=CC(=N2)NC(=O)CC3=CC=C(C=C3)OC)N4C(=CC(=N4)C)C
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Product OPENEYE NAME: (2S)-2-[[[(2S)-2-carboxy-2-hydroxy-ethyl]-(cyclohexylmethyl)carbamoyl]amino]-3-(4-hydroxyphenyl)propanoic acid
CAS Name: (2S)-2-[[[[(2S)-2-carboxy-2-hydroxyethyl]-(cyclohexylmethyl)amino]-oxomethyl]amino]-3-(4-hydroxyphenyl)propanoic acid
IUPAC NAME: (2S)-2-[[[(2S)-2-carboxy-2-hydroxyethyl]-(cyclohexylmethyl)carbamoyl]amino]-3-(4-hydroxyphenyl)propanoic acid
SYSTEMATIC NAME: (2S)-2-[[[(2S)-2,3-bis(oxidanyl)-3-oxidanylidene-propyl]-(cyclohexylmethyl)carbamoyl]amino]-3-(4-hydroxyphenyl)propanoic acid
MOLECULAR FORMULA: C20H28N2O7
MOLECULAR WEIGHT: 408.44552
SMILES: C1CCC(CC1)CN(C[C@@H](C(=O)O)O)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)O
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Product OPENEYE NAME: 3-bromo-7-[(2-ethyl-6-methyl-phenyl)methylamino]-N,N,2-trimethyl-1H-pyrrolo[3,2-b]pyridine-5-carboxamide
CAS Name: 3-bromo-7-[(2-ethyl-6-methylphenyl)methylamino]-N,N,2-trimethyl-1H-pyrrolo[3,2-b]pyridine-5-carboxamide
IUPAC NAME: 3-bromo-7-[(2-ethyl-6-methylphenyl)methylamino]-N,N,2-trimethyl-1H-pyrrolo[3,2-b]pyridine-5-carboxamide
SYSTEMATIC NAME: 3-bromanyl-7-[(2-ethyl-6-methyl-phenyl)methylamino]-N,N,2-trimethyl-1H-pyrrolo[3,2-b]pyridine-5-carboxamide
MOLECULAR FORMULA: C21H25BrN4O
MOLECULAR WEIGHT: 429.3534
SMILES: CCC1=CC=CC(=C1CNC2=CC(=NC3=C2NC(=C3Br)C)C(=O)N(C)C)C
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Product OPENEYE NAME: 7-[(2,6-dimethylphenyl)methylamino]-N,N,2-trimethyl-1H-pyrrolo[3,2-b]pyridine-5-carboxamide
CAS Name: 7-[(2,6-dimethylphenyl)methylamino]-N,N,2-trimethyl-1H-pyrrolo[3,2-b]pyridine-5-carboxamide
IUPAC NAME: 7-[(2,6-dimethylphenyl)methylamino]-N,N,2-trimethyl-1H-pyrrolo[3,2-b]pyridine-5-carboxamide
SYSTEMATIC NAME: 7-[(2,6-dimethylphenyl)methylamino]-N,N,2-trimethyl-1H-pyrrolo[3,2-b]pyridine-5-carboxamide
MOLECULAR FORMULA: C20H24N4O
MOLECULAR WEIGHT: 336.43076
SMILES: CC1=C(C(=CC=C1)C)CNC2=CC(=NC3=C2NC(=C3)C)C(=O)N(C)C
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Product OPENEYE NAME: 7-[(2,6-dimethylphenyl)methylamino]-N,2-dimethyl-1H-pyrrolo[3,2-b]pyridine-5-carboxamide
CAS Name: 7-[(2,6-dimethylphenyl)methylamino]-N,2-dimethyl-1H-pyrrolo[3,2-b]pyridine-5-carboxamide
IUPAC NAME: 7-[(2,6-dimethylphenyl)methylamino]-N,2-dimethyl-1H-pyrrolo[3,2-b]pyridine-5-carboxamide
SYSTEMATIC NAME: 7-[(2,6-dimethylphenyl)methylamino]-N,2-dimethyl-1H-pyrrolo[3,2-b]pyridine-5-carboxamide
MOLECULAR FORMULA: C19H22N4O
MOLECULAR WEIGHT: 322.40418
SMILES: CC1=C(C(=CC=C1)C)CNC2=CC(=NC3=C2NC(=C3)C)C(=O)NC
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Product OPENEYE NAME: 7-[(2-ethyl-6-methyl-phenyl)methylamino]-N,N,2-trimethyl-1H-pyrrolo[3,2-b]pyridine-5-carboxamide
CAS Name: 7-[(2-ethyl-6-methylphenyl)methylamino]-N,N,2-trimethyl-1H-pyrrolo[3,2-b]pyridine-5-carboxamide
IUPAC NAME: 7-[(2-ethyl-6-methylphenyl)methylamino]-N,N,2-trimethyl-1H-pyrrolo[3,2-b]pyridine-5-carboxamide
SYSTEMATIC NAME: 7-[(2-ethyl-6-methyl-phenyl)methylamino]-N,N,2-trimethyl-1H-pyrrolo[3,2-b]pyridine-5-carboxamide
MOLECULAR FORMULA: C21H26N4O
MOLECULAR WEIGHT: 350.45734
SMILES: CCC1=CC=CC(=C1CNC2=CC(=NC3=C2NC(=C3)C)C(=O)N(C)C)C
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Product OPENEYE NAME: N-[(1S,2R)-1-benzyl-3-[[(1S)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl]amino]-2-hydroxy-propyl]-3-ethoxy-5-pyrrolidin-1-yl-benzamide
CAS Name: N-[(2S,3R)-4-[[(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl]amino]-3-hydroxy-1-phenylbutan-2-yl]-3-ethoxy-5-(1-pyrrolidinyl)benzamide
IUPAC NAME: N-[(2S,3R)-4-[[(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl]amino]-3-hydroxy-1-phenylbutan-2-yl]-3-ethoxy-5-pyrrolidin-1-ylbenzamide
SYSTEMATIC NAME: N-[(2S,3R)-4-[[(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]amino]-3-oxidanyl-1-phenyl-butan-2-yl]-3-ethoxy-5-pyrrolidin-1-yl-benzamide
MOLECULAR FORMULA: C32H46N4O4
MOLECULAR WEIGHT: 550.73204
SMILES: CCOC1=CC(=CC(=C1)N2CCCC2)C(=O)N[C@@H](CC3=CC=CC=C3)[C@@H](CN[C@@H](C)C(=O)NC4CCCCC4)O
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Product OPENEYE NAME: N-[(1S,2R)-1-benzyl-3-[[(1S)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl]amino]-2-hydroxy-propyl]-3-(2-oxopyrrolidin-1-yl)-5-propoxy-benzamide
CAS Name: N-[(2S,3R)-4-[[(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl]amino]-3-hydroxy-1-phenylbutan-2-yl]-3-(2-oxo-1-pyrrolidinyl)-5-propoxybenzamide
IUPAC NAME: N-[(2S,3R)-4-[[(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl]amino]-3-hydroxy-1-phenylbutan-2-yl]-3-(2-oxopyrrolidin-1-yl)-5-propoxybenzamide
SYSTEMATIC NAME: N-[(2S,3R)-4-[[(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]amino]-3-oxidanyl-1-phenyl-butan-2-yl]-3-(2-oxidanylidenepyrrolidin-1-yl)-5-propoxy-benzamide
MOLECULAR FORMULA: C33H46N4O5
MOLECULAR WEIGHT: 578.74214
SMILES: CCCOC1=CC(=CC(=C1)N2CCCC2=O)C(=O)N[C@@H](CC3=CC=CC=C3)[C@@H](CN[C@@H](C)C(=O)NC4CCCCC4)O
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Product OPENEYE NAME: (2S)-1-[2-(1,5-dimethylbenzimidazol-2-yl)sulfanylacetyl]-N-(2-pyrrol-1-ylphenyl)pyrrolidine-2-carboxamide
CAS Name: (2S)-1-[2-[(1,5-dimethyl-2-benzimidazolyl)thio]-1-oxoethyl]-N-[2-(1-pyrrolyl)phenyl]-2-pyrrolidinecarboxamide
IUPAC NAME: (2S)-1-[2-(1,5-dimethylbenzimidazol-2-yl)sulfanylacetyl]-N-(2-pyrrol-1-ylphenyl)pyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2S)-1-[2-(1,5-dimethylbenzimidazol-2-yl)sulfanylethanoyl]-N-(2-pyrrol-1-ylphenyl)pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C26H27N5O2S
MOLECULAR WEIGHT: 473.58988
SMILES: CC1=CC2=C(C=C1)N(C(=N2)SCC(=O)N3CCC[C@H]3C(=O)NC4=CC=CC=C4N5C=CC=C5)C
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Product OPENEYE NAME: (2S)-1-[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]-N-(2-pyrrol-1-ylphenyl)pyrrolidine-2-carboxamide
CAS Name: (2S)-1-[2-(1,3-benzoxazol-2-ylthio)-1-oxoethyl]-N-[2-(1-pyrrolyl)phenyl]-2-pyrrolidinecarboxamide
IUPAC NAME: (2S)-1-[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]-N-(2-pyrrol-1-ylphenyl)pyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2S)-1-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoyl]-N-(2-pyrrol-1-ylphenyl)pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C24H22N4O3S
MOLECULAR WEIGHT: 446.52148
SMILES: C1C[C@H](N(C1)C(=O)CSC2=NC3=CC=CC=C3O2)C(=O)NC4=CC=CC=C4N5C=CC=C5
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Product OPENEYE NAME: (2S)-1-[2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]acetyl]-N-(2-pyrrol-1-ylphenyl)pyrrolidine-2-carboxamide
CAS Name: (2S)-1-[2-[(6-methyl-1H-benzimidazol-2-yl)thio]-1-oxoethyl]-N-[2-(1-pyrrolyl)phenyl]-2-pyrrolidinecarboxamide
IUPAC NAME: (2S)-1-[2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]acetyl]-N-(2-pyrrol-1-ylphenyl)pyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2S)-1-[2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanoyl]-N-(2-pyrrol-1-ylphenyl)pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C25H25N5O2S
MOLECULAR WEIGHT: 459.5633
SMILES: CC1=CC2=C(C=C1)N=C(N2)SCC(=O)N3CCC[C@H]3C(=O)NC4=CC=CC=C4N5C=CC=C5
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Product OPENEYE NAME: methyl 2-(cyclohexylcarbamoyl)-6-methyl-3-(2-phenylethyl)-1H-indole-5-carboxylate
CAS Name: 2-[(cyclohexylamino)-oxomethyl]-6-methyl-3-(2-phenylethyl)-1H-indole-5-carboxylic acid methyl ester
IUPAC NAME: methyl 2-(cyclohexylcarbamoyl)-6-methyl-3-(2-phenylethyl)-1H-indole-5-carboxylate
SYSTEMATIC NAME: methyl 2-(cyclohexylcarbamoyl)-6-methyl-3-(2-phenylethyl)-1H-indole-5-carboxylate
MOLECULAR FORMULA: C26H30N2O3
MOLECULAR WEIGHT: 418.528
SMILES: CC1=C(C=C2C(=C1)NC(=C2CCC3=CC=CC=C3)C(=O)NC4CCCCC4)C(=O)OC
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Product OPENEYE NAME: 1-(4-chlorophenyl)-N-(4-chlorophenyl)sulfonyl-N'-methyl-2-phenyl-4,5-dihydroimidazole-4-carboxamidine
CAS Name: 1-(4-chlorophenyl)-N-(4-chlorophenyl)sulfonyl-N'-methyl-2-phenyl-4,5-dihydroimidazole-4-carboximidamide
IUPAC NAME: 1-(4-chlorophenyl)-N-(4-chlorophenyl)sulfonyl-N'-methyl-2-phenyl-4,5-dihydroimidazole-4-carboximidamide
SYSTEMATIC NAME: 1-(4-chlorophenyl)-N-(4-chlorophenyl)sulfonyl-N'-methyl-2-phenyl-4,5-dihydroimidazole-4-carboximidamide
MOLECULAR FORMULA: C23H20Cl2N4O2S
MOLECULAR WEIGHT: 487.4015
SMILES: CN=C(C1CN(C(=N1)C2=CC=CC=C2)C3=CC=C(C=C3)Cl)NS(=O)(=O)C4=CC=C(C=C4)Cl
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Product OPENEYE NAME: (4S)-4-[[(2S)-1-[(2S)-5-amino-2-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxo-pentanoyl]amino]-4-methyl-pentanoyl]amino]-5-oxo-pentanoyl]pyrrolidine-2-carbonyl]amino]-3-phenyl-propanoyl]pyrrolidine-2-carbonyl]amino]-5-oxo-pen
CAS Name: (4S)-4-[[[(2S)-1-[(2S)-5-amino-2-[[[(2S)-1-[(2S)-2-[[[(2S)-1-[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,5-diamino-1,5-dioxopentyl]amino]-4-methyl-1-oxopentyl]amino]-1,5-dioxopentyl]-2-pyrrolidinyl]-oxomethyl]amino]-1-oxo-3-phenylpropyl]-2-pyrrolidinyl]-oxomethyl]a
IUPAC NAME: (4S)-4-[[(2S)-1-[(2S)-5-amino-2-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]amino]-4-methylpentanoyl]amino]-5-oxopentanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]-5-oxopentanoy
SYSTEMATIC NAME: (4S)-4-[[(2S)-1-[(2S)-5-azanyl-2-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2S)-5-azanyl-2-[[(2S)-2-[[(2S)-2,5-bis(azanyl)-5-oxidanylidene-pentanoyl]amino]-4-methyl-pentanoyl]amino]-5-oxidanylidene-pentanoyl]pyrrolidin-2-yl]carbonylamino]-3-phenyl-propanoyl]pyrrolidin-2
MOLECULAR FORMULA: C70H101N15O19
MOLECULAR WEIGHT: 1456.64004
SMILES: CC(C)C[C@@H](C(=O)N[C@@H](CCC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCC(=O)N)C(=O)N4CCC[C@H]4C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N5CCC[C@H]5C(=O)N[C@@H](CC6=CC=C(C=C6)O)C(=O)O)NC(=O)[C@H](CCC(=O)N)N
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Product OPENEYE NAME: 2-(cyclohexylcarbamoyl)-1,6-dimethyl-3-(2-phenylethyl)indole-5-carboxylic acid
CAS Name: 2-[(cyclohexylamino)-oxomethyl]-1,6-dimethyl-3-(2-phenylethyl)-5-indolecarboxylic acid
IUPAC NAME: 2-(cyclohexylcarbamoyl)-1,6-dimethyl-3-(2-phenylethyl)indole-5-carboxylic acid
SYSTEMATIC NAME: 2-(cyclohexylcarbamoyl)-1,6-dimethyl-3-(2-phenylethyl)indole-5-carboxylic acid
MOLECULAR FORMULA: C26H30N2O3
MOLECULAR WEIGHT: 418.528
SMILES: CC1=C(C=C2C(=C1)N(C(=C2CCC3=CC=CC=C3)C(=O)NC4CCCCC4)C)C(=O)O
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Product OPENEYE NAME: (2S,3S,4R,5R)-5-[2-chloro-6-(dimethylamino)purin-9-yl]-3,4-dihydroxy-N,N-dimethyl-tetrahydrothiophene-2-carboxamide
CAS Name: (2S,3S,4R,5R)-5-[2-chloro-6-(dimethylamino)-9-purinyl]-3,4-dihydroxy-N,N-dimethyl-2-thiolanecarboxamide
IUPAC NAME: (2S,3S,4R,5R)-5-[2-chloro-6-(dimethylamino)purin-9-yl]-3,4-dihydroxy-N,N-dimethylthiolane-2-carboxamide
SYSTEMATIC NAME: (2S,3S,4R,5R)-5-[2-chloranyl-6-(dimethylamino)purin-9-yl]-N,N-dimethyl-3,4-bis(oxidanyl)thiolane-2-carboxamide
MOLECULAR FORMULA: C14H19ClN6O3S
MOLECULAR WEIGHT: 386.85706
SMILES: CN(C)C1=NC(=NC2=C1N=CN2[C@H]3[C@@H]([C@@H]([C@H](S3)C(=O)N(C)C)O)O)Cl
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Product OPENEYE NAME: (2S,3S,4R,5R)-5-[2-chloro-6-[(3-chlorophenyl)methylamino]purin-9-yl]-3,4-dihydroxy-N,N-dimethyl-tetrahydrothiophene-2-carboxamide
CAS Name: (2S,3S,4R,5R)-5-[2-chloro-6-[(3-chlorophenyl)methylamino]-9-purinyl]-3,4-dihydroxy-N,N-dimethyl-2-thiolanecarboxamide
IUPAC NAME: (2S,3S,4R,5R)-5-[2-chloro-6-[(3-chlorophenyl)methylamino]purin-9-yl]-3,4-dihydroxy-N,N-dimethylthiolane-2-carboxamide
SYSTEMATIC NAME: (2S,3S,4R,5R)-5-[2-chloranyl-6-[(3-chlorophenyl)methylamino]purin-9-yl]-N,N-dimethyl-3,4-bis(oxidanyl)thiolane-2-carboxamide
MOLECULAR FORMULA: C19H20Cl2N6O3S
MOLECULAR WEIGHT: 483.3715
SMILES: CN(C)C(=O)[C@@H]1[C@H]([C@H]([C@@H](S1)N2C=NC3=C2N=C(N=C3NCC4=CC(=CC=C4)Cl)Cl)O)O
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CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H16N4O4
MOLECULAR WEIGHT: 376.36544
SMILES: COC1=CC=C(C=C1)CN2CC3=C(C2=O)N=C4C=C(NN4C3=O)C5=CC=CO5
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Product OPENEYE NAME: (2S,3S,4R,5R)-5-[2-chloro-6-[(3-fluorophenyl)methylamino]purin-9-yl]-3,4-dihydroxy-N,N-dimethyl-tetrahydrothiophene-2-carboxamide
CAS Name: (2S,3S,4R,5R)-5-[2-chloro-6-[(3-fluorophenyl)methylamino]-9-purinyl]-3,4-dihydroxy-N,N-dimethyl-2-thiolanecarboxamide
IUPAC NAME: (2S,3S,4R,5R)-5-[2-chloro-6-[(3-fluorophenyl)methylamino]purin-9-yl]-3,4-dihydroxy-N,N-dimethylthiolane-2-carboxamide
SYSTEMATIC NAME: (2S,3S,4R,5R)-5-[2-chloranyl-6-[(3-fluorophenyl)methylamino]purin-9-yl]-N,N-dimethyl-3,4-bis(oxidanyl)thiolane-2-carboxamide
MOLECULAR FORMULA: C19H20ClFN6O3S
MOLECULAR WEIGHT: 466.916903
SMILES: CN(C)C(=O)[C@@H]1[C@H]([C@H]([C@@H](S1)N2C=NC3=C2N=C(N=C3NCC4=CC(=CC=C4)F)Cl)O)O
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SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H13N5O3
MOLECULAR WEIGHT: 347.32752
SMILES: C1C2=C(C(=O)N1CC3=CC=CC=N3)N=C4C=C(NN4C2=O)C5=CC=CO5
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