Product OPENEYE NAME: (5R)-5-methyl-N-[[6-(4-methylpiperazin-1-yl)-3-pyridyl]methyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide
CAS Name: (5R)-5-methyl-N-[[6-(4-methyl-1-piperazinyl)-3-pyridinyl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
IUPAC NAME: (5R)-5-methyl-N-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
SYSTEMATIC NAME: (5R)-5-methyl-N-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
MOLECULAR FORMULA: C21H28N4OS
MOLECULAR WEIGHT: 384.53822
SMILES: C[C@@H]1CCC2=C(C1)C=C(S2)C(=O)NCC3=CN=C(C=C3)N4CCN(CC4)C
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Product OPENEYE NAME: (5S)-5-methyl-N-[[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]methyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide
CAS Name: (5S)-5-methyl-N-[[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
IUPAC NAME: (5S)-5-methyl-N-[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
SYSTEMATIC NAME: (5S)-5-methyl-N-[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
MOLECULAR FORMULA: C21H29N4OS+
MOLECULAR WEIGHT: 385.54616
SMILES: C[C@H]1CCC2=C(C1)C=C(S2)C(=O)NCC3=CN=C(C=C3)N4CC[NH+](CC4)C
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Product OPENEYE NAME: (5S)-5-methyl-N-[[6-(4-methylpiperazin-1-yl)-3-pyridyl]methyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide
CAS Name: (5S)-5-methyl-N-[[6-(4-methyl-1-piperazinyl)-3-pyridinyl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
IUPAC NAME: (5S)-5-methyl-N-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
SYSTEMATIC NAME: (5S)-5-methyl-N-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
MOLECULAR FORMULA: C21H28N4OS
MOLECULAR WEIGHT: 384.53822
SMILES: C[C@H]1CCC2=C(C1)C=C(S2)C(=O)NCC3=CN=C(C=C3)N4CCN(CC4)C
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Product OPENEYE NAME: 2,4-dichloro-N-(3-phenylprop-2-ynyl)benzamide
CAS Name: 2,4-dichloro-N-(3-phenylprop-2-ynyl)benzamide
IUPAC NAME: 2,4-dichloro-N-(3-phenylprop-2-ynyl)benzamide
SYSTEMATIC NAME: 2,4-bis(chloranyl)-N-(3-phenylprop-2-ynyl)benzamide
MOLECULAR FORMULA: C16H11Cl2NO
MOLECULAR WEIGHT: 304.17064
SMILES: C1=CC=C(C=C1)C#CCNC(=O)C2=C(C=C(C=C2)Cl)Cl
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Product OPENEYE NAME: 2-(4-chlorophenoxy)-2-methyl-N-(3-phenylprop-2-ynyl)propanamide
CAS Name: 2-(4-chlorophenoxy)-2-methyl-N-(3-phenylprop-2-ynyl)propanamide
IUPAC NAME: 2-(4-chlorophenoxy)-2-methyl-N-(3-phenylprop-2-ynyl)propanamide
SYSTEMATIC NAME: 2-(4-chloranylphenoxy)-2-methyl-N-(3-phenylprop-2-ynyl)propanamide
MOLECULAR FORMULA: C19H18ClNO2
MOLECULAR WEIGHT: 327.80472
SMILES: CC(C)(C(=O)NCC#CC1=CC=CC=C1)OC2=CC=C(C=C2)Cl
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Product OPENEYE NAME: 2-benzylsulfanyl-5-[3-(3-chloro-2-methyl-anilino)-3-oxo-propyl]-6-methyl-pyrimidin-4-olate
CAS Name: 5-[3-(3-chloro-2-methylanilino)-3-oxopropyl]-6-methyl-2-(phenylmethylthio)-4-pyrimidinolate
IUPAC NAME: 2-benzylsulfanyl-5-[3-(3-chloro-2-methylanilino)-3-oxopropyl]-6-methylpyrimidin-4-olate
SYSTEMATIC NAME: 5-[3-[(3-chloranyl-2-methyl-phenyl)amino]-3-oxidanylidene-propyl]-6-methyl-2-(phenylmethylsulfanyl)pyrimidin-4-olate
MOLECULAR FORMULA: C22H21ClN3O2S-
MOLECULAR WEIGHT: 426.93904
SMILES: CC1=C(C=CC=C1Cl)NC(=O)CCC2=C(N=C(N=C2[O-])SCC3=CC=CC=C3)C
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Product OPENEYE NAME: 3-(2-benzylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)-N-(3-chloro-2-methyl-phenyl)propanamide
CAS Name: N-(3-chloro-2-methylphenyl)-3-[6-methyl-4-oxo-2-(phenylmethylthio)-1H-pyrimidin-5-yl]propanamide
IUPAC NAME: 3-(2-benzylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)-N-(3-chloro-2-methylphenyl)propanamide
SYSTEMATIC NAME: N-(3-chloranyl-2-methyl-phenyl)-3-[6-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]propanamide
MOLECULAR FORMULA: C22H22ClN3O2S
MOLECULAR WEIGHT: 427.94698
SMILES: CC1=C(C=CC=C1Cl)NC(=O)CCC2=C(NC(=NC2=O)SCC3=CC=CC=C3)C
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Product OPENEYE NAME: N-(4-cyanophenyl)-2-[(2-methylthiazol-4-yl)methylsulfanyl]benzamide
CAS Name: N-(4-cyanophenyl)-2-[(2-methyl-4-thiazolyl)methylthio]benzamide
IUPAC NAME: N-(4-cyanophenyl)-2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzamide
SYSTEMATIC NAME: N-(4-cyanophenyl)-2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzamide
MOLECULAR FORMULA: C19H15N3OS2
MOLECULAR WEIGHT: 365.4719
SMILES: CC1=NC(=CS1)CSC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C#N
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Product OPENEYE NAME: isopropyl (6S)-3-(4-cyanophenyl)-4-methyl-2-oxo-6-(3-thienyl)-1,6-dihydropyrimidine-5-carboxylate
CAS Name: (6S)-3-(4-cyanophenyl)-4-methyl-2-oxo-6-(3-thiophenyl)-1,6-dihydropyrimidine-5-carboxylic acid propan-2-yl ester
IUPAC NAME: propan-2-yl (6S)-3-(4-cyanophenyl)-4-methyl-2-oxo-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate
SYSTEMATIC NAME: propan-2-yl (6S)-3-(4-cyanophenyl)-4-methyl-2-oxidanylidene-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate
MOLECULAR FORMULA: C20H19N3O3S
MOLECULAR WEIGHT: 381.44816
SMILES: CC1=C([C@H](NC(=O)N1C2=CC=C(C=C2)C#N)C3=CSC=C3)C(=O)OC(C)C
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Product OPENEYE NAME: isopropyl (6R)-3-(4-cyanophenyl)-4-methyl-2-oxo-6-(3-thienyl)-1,6-dihydropyrimidine-5-carboxylate
CAS Name: (6R)-3-(4-cyanophenyl)-4-methyl-2-oxo-6-(3-thiophenyl)-1,6-dihydropyrimidine-5-carboxylic acid propan-2-yl ester
IUPAC NAME: propan-2-yl (6R)-3-(4-cyanophenyl)-4-methyl-2-oxo-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate
SYSTEMATIC NAME: propan-2-yl (6R)-3-(4-cyanophenyl)-4-methyl-2-oxidanylidene-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate
MOLECULAR FORMULA: C20H19N3O3S
MOLECULAR WEIGHT: 381.44816
SMILES: CC1=C([C@@H](NC(=O)N1C2=CC=C(C=C2)C#N)C3=CSC=C3)C(=O)OC(C)C
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Product OPENEYE NAME: N-(2,3-dimethylphenyl)-2-[3-(2-methoxyethyl)-4-oxo-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-acetamide
CAS Name: N-(2,3-dimethylphenyl)-2-[[3-(2-methoxyethyl)-4-oxo-2-pyrido[2,3-d]pyrimidinyl]thio]acetamide
IUPAC NAME: N-(2,3-dimethylphenyl)-2-[3-(2-methoxyethyl)-4-oxopyrido[2,3-d]pyrimidin-2-yl]sulfanylacetamide
SYSTEMATIC NAME: N-(2,3-dimethylphenyl)-2-[3-(2-methoxyethyl)-4-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-ethanamide
MOLECULAR FORMULA: C20H22N4O3S
MOLECULAR WEIGHT: 398.47868
SMILES: CC1=C(C(=CC=C1)NC(=O)CSC2=NC3=C(C=CC=N3)C(=O)N2CCOC)C
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Product OPENEYE NAME: N-(2,4-difluorophenyl)-2-[3-(2-methoxyethyl)-4-oxo-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-acetamide
CAS Name: N-(2,4-difluorophenyl)-2-[[3-(2-methoxyethyl)-4-oxo-2-pyrido[2,3-d]pyrimidinyl]thio]acetamide
IUPAC NAME: N-(2,4-difluorophenyl)-2-[3-(2-methoxyethyl)-4-oxopyrido[2,3-d]pyrimidin-2-yl]sulfanylacetamide
SYSTEMATIC NAME: N-[2,4-bis(fluoranyl)phenyl]-2-[3-(2-methoxyethyl)-4-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-ethanamide
MOLECULAR FORMULA: C18H16F2N4O3S
MOLECULAR WEIGHT: 406.406446
SMILES: COCCN1C(=O)C2=C(N=CC=C2)N=C1SCC(=O)NC3=C(C=C(C=C3)F)F
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Product OPENEYE NAME: N-(2-chloro-4-fluoro-phenyl)-2-[3-(2-methoxyethyl)-4-oxo-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-acetamide
CAS Name: N-(2-chloro-4-fluorophenyl)-2-[[3-(2-methoxyethyl)-4-oxo-2-pyrido[2,3-d]pyrimidinyl]thio]acetamide
IUPAC NAME: N-(2-chloro-4-fluorophenyl)-2-[3-(2-methoxyethyl)-4-oxopyrido[2,3-d]pyrimidin-2-yl]sulfanylacetamide
SYSTEMATIC NAME: N-(2-chloranyl-4-fluoranyl-phenyl)-2-[3-(2-methoxyethyl)-4-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-ethanamide
MOLECULAR FORMULA: C18H16ClFN4O3S
MOLECULAR WEIGHT: 422.861043
SMILES: COCCN1C(=O)C2=C(N=CC=C2)N=C1SCC(=O)NC3=C(C=C(C=C3)F)Cl
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Product OPENEYE NAME: N-(2,5-dimethylphenyl)-2-[3-(2-methoxyethyl)-4-oxo-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-acetamide
CAS Name: N-(2,5-dimethylphenyl)-2-[[3-(2-methoxyethyl)-4-oxo-2-pyrido[2,3-d]pyrimidinyl]thio]acetamide
IUPAC NAME: N-(2,5-dimethylphenyl)-2-[3-(2-methoxyethyl)-4-oxopyrido[2,3-d]pyrimidin-2-yl]sulfanylacetamide
SYSTEMATIC NAME: N-(2,5-dimethylphenyl)-2-[3-(2-methoxyethyl)-4-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-ethanamide
MOLECULAR FORMULA: C20H22N4O3S
MOLECULAR WEIGHT: 398.47868
SMILES: CC1=CC(=C(C=C1)C)NC(=O)CSC2=NC3=C(C=CC=N3)C(=O)N2CCOC
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Product OPENEYE NAME: N-(5-chloro-2-methoxy-phenyl)-2-[3-(2-methoxyethyl)-4-oxo-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-acetamide
CAS Name: N-(5-chloro-2-methoxyphenyl)-2-[[3-(2-methoxyethyl)-4-oxo-2-pyrido[2,3-d]pyrimidinyl]thio]acetamide
IUPAC NAME: N-(5-chloro-2-methoxyphenyl)-2-[3-(2-methoxyethyl)-4-oxopyrido[2,3-d]pyrimidin-2-yl]sulfanylacetamide
SYSTEMATIC NAME: N-(5-chloranyl-2-methoxy-phenyl)-2-[3-(2-methoxyethyl)-4-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-ethanamide
MOLECULAR FORMULA: C19H19ClN4O4S
MOLECULAR WEIGHT: 434.89656
SMILES: COCCN1C(=O)C2=C(N=CC=C2)N=C1SCC(=O)NC3=C(C=CC(=C3)Cl)OC
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Product OPENEYE NAME: 2-[3-(2-methoxyethyl)-4-oxo-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-N-(4-phenylphenyl)acetamide
CAS Name: 2-[[3-(2-methoxyethyl)-4-oxo-2-pyrido[2,3-d]pyrimidinyl]thio]-N-(4-phenylphenyl)acetamide
IUPAC NAME: 2-[3-(2-methoxyethyl)-4-oxopyrido[2,3-d]pyrimidin-2-yl]sulfanyl-N-(4-phenylphenyl)acetamide
SYSTEMATIC NAME: 2-[3-(2-methoxyethyl)-4-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-N-(4-phenylphenyl)ethanamide
MOLECULAR FORMULA: C24H22N4O3S
MOLECULAR WEIGHT: 446.52148
SMILES: COCCN1C(=O)C2=C(N=CC=C2)N=C1SCC(=O)NC3=CC=C(C=C3)C4=CC=CC=C4
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Product OPENEYE NAME: 2-[3-(2-methoxyethyl)-4-oxo-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-N-[2-(2-thienyl)ethyl]acetamide
CAS Name: 2-[[3-(2-methoxyethyl)-4-oxo-2-pyrido[2,3-d]pyrimidinyl]thio]-N-(2-thiophen-2-ylethyl)acetamide
IUPAC NAME: 2-[3-(2-methoxyethyl)-4-oxopyrido[2,3-d]pyrimidin-2-yl]sulfanyl-N-(2-thiophen-2-ylethyl)acetamide
SYSTEMATIC NAME: 2-[3-(2-methoxyethyl)-4-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-N-(2-thiophen-2-ylethyl)ethanamide
MOLECULAR FORMULA: C18H20N4O3S2
MOLECULAR WEIGHT: 404.5064
SMILES: COCCN1C(=O)C2=C(N=CC=C2)N=C1SCC(=O)NCCC3=CC=CS3
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Product OPENEYE NAME: 3-(2-methoxyethyl)-2-(3-phenoxypropylsulfanyl)pyrido[2,3-d]pyrimidin-4-one
CAS Name: 3-(2-methoxyethyl)-2-(3-phenoxypropylthio)-4-pyrido[2,3-d]pyrimidinone
IUPAC NAME: 3-(2-methoxyethyl)-2-(3-phenoxypropylsulfanyl)pyrido[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 3-(2-methoxyethyl)-2-(3-phenoxypropylsulfanyl)pyrido[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C19H21N3O3S
MOLECULAR WEIGHT: 371.45334
SMILES: COCCN1C(=O)C2=C(N=CC=C2)N=C1SCCCOC3=CC=CC=C3
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Product OPENEYE NAME: N-[(1S)-1-(2-furyl)ethyl]-2-[3-(2-methoxyethyl)-4-oxo-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-acetamide
CAS Name: N-[(1S)-1-(2-furanyl)ethyl]-2-[[3-(2-methoxyethyl)-4-oxo-2-pyrido[2,3-d]pyrimidinyl]thio]acetamide
IUPAC NAME: N-[(1S)-1-(furan-2-yl)ethyl]-2-[3-(2-methoxyethyl)-4-oxopyrido[2,3-d]pyrimidin-2-yl]sulfanylacetamide
SYSTEMATIC NAME: N-[(1S)-1-(furan-2-yl)ethyl]-2-[3-(2-methoxyethyl)-4-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-ethanamide
MOLECULAR FORMULA: C18H20N4O4S
MOLECULAR WEIGHT: 388.4408
SMILES: C[C@@H](C1=CC=CO1)NC(=O)CSC2=NC3=C(C=CC=N3)C(=O)N2CCOC
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Product OPENEYE NAME: N-[(1R)-1-(2-furyl)ethyl]-2-[3-(2-methoxyethyl)-4-oxo-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-acetamide
CAS Name: N-[(1R)-1-(2-furanyl)ethyl]-2-[[3-(2-methoxyethyl)-4-oxo-2-pyrido[2,3-d]pyrimidinyl]thio]acetamide
IUPAC NAME: N-[(1R)-1-(furan-2-yl)ethyl]-2-[3-(2-methoxyethyl)-4-oxopyrido[2,3-d]pyrimidin-2-yl]sulfanylacetamide
SYSTEMATIC NAME: N-[(1R)-1-(furan-2-yl)ethyl]-2-[3-(2-methoxyethyl)-4-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-ethanamide
MOLECULAR FORMULA: C18H20N4O4S
MOLECULAR WEIGHT: 388.4408
SMILES: C[C@H](C1=CC=CO1)NC(=O)CSC2=NC3=C(C=CC=N3)C(=O)N2CCOC
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Product OPENEYE NAME: (2R)-N-cyclopentyl-2-[[5-(2-thienylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide
CAS Name: (2R)-N-cyclopentyl-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]thio]propanamide
IUPAC NAME: (2R)-N-cyclopentyl-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide
SYSTEMATIC NAME: (2R)-N-cyclopentyl-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide
MOLECULAR FORMULA: C15H20N4OS2
MOLECULAR WEIGHT: 336.4755
SMILES: C[C@H](C(=O)NC1CCCC1)SC2=NNC(=N2)CC3=CC=CS3
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