Product OPENEYE NAME: ethyl 4-[[(E)-2-(4-chlorophenyl)sulfonyl-2-cyano-vinyl]amino]piperidine-1-carboxylate
CAS Name: 4-[[(E)-2-(4-chlorophenyl)sulfonyl-2-cyanoethenyl]amino]-1-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 4-[[(E)-2-(4-chlorophenyl)sulfonyl-2-cyanoethenyl]amino]piperidine-1-carboxylate
SYSTEMATIC NAME: ethyl 4-[[(E)-2-(4-chlorophenyl)sulfonyl-2-cyano-ethenyl]amino]piperidine-1-carboxylate
MOLECULAR FORMULA: C17H20ClN3O4S
MOLECULAR WEIGHT: 397.8764
SMILES: CCOC(=O)N1CCC(CC1)N/C=C(\C#N)/S(=O)(=O)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: 2-[(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)methylsulfanyl]-N-phenyl-acetamide
CAS Name: 2-[[4-methyl-5-(phenacylthio)-1,2,4-triazol-3-yl]methylthio]-N-phenylacetamide
IUPAC NAME: 2-[(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)methylsulfanyl]-N-phenylacetamide
SYSTEMATIC NAME: 2-[(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)methylsulfanyl]-N-phenyl-ethanamide
MOLECULAR FORMULA: C20H20N4O2S2
MOLECULAR WEIGHT: 412.5284
SMILES: CN1C(=NN=C1SCC(=O)C2=CC=CC=C2)CSCC(=O)NC3=CC=CC=C3
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Product OPENEYE NAME: 2-[[5-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenyl-acetamide
CAS Name: 2-[[5-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-4-methyl-1,2,4-triazol-3-yl]methylthio]-N-phenylacetamide
IUPAC NAME: 2-[[5-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenylacetamide
SYSTEMATIC NAME: 2-[[5-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenyl-ethanamide
MOLECULAR FORMULA: C20H19ClN4O2S2
MOLECULAR WEIGHT: 446.97346
SMILES: CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)Cl)CSCC(=O)NC3=CC=CC=C3
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Product OPENEYE NAME: 2-[[4-methyl-5-[2-oxo-2-[4-(trifluoromethyl)phenyl]ethyl]sulfanyl-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenyl-acetamide
CAS Name: 2-[[4-methyl-5-[[2-oxo-2-[4-(trifluoromethyl)phenyl]ethyl]thio]-1,2,4-triazol-3-yl]methylthio]-N-phenylacetamide
IUPAC NAME: 2-[[4-methyl-5-[2-oxo-2-[4-(trifluoromethyl)phenyl]ethyl]sulfanyl-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenylacetamide
SYSTEMATIC NAME: 2-[[4-methyl-5-[2-oxidanylidene-2-[4-(trifluoromethyl)phenyl]ethyl]sulfanyl-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenyl-ethanamide
MOLECULAR FORMULA: C21H19F3N4O2S2
MOLECULAR WEIGHT: 480.52637
SMILES: CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)C(F)(F)F)CSCC(=O)NC3=CC=CC=C3
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Product OPENEYE NAME: 2-[[5-[2-(3,4-difluorophenyl)-2-oxo-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenyl-acetamide
CAS Name: 2-[[5-[[2-(3,4-difluorophenyl)-2-oxoethyl]thio]-4-methyl-1,2,4-triazol-3-yl]methylthio]-N-phenylacetamide
IUPAC NAME: 2-[[5-[2-(3,4-difluorophenyl)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenylacetamide
SYSTEMATIC NAME: 2-[[5-[2-[3,4-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenyl-ethanamide
MOLECULAR FORMULA: C20H18F2N4O2S2
MOLECULAR WEIGHT: 448.509326
SMILES: CN1C(=NN=C1SCC(=O)C2=CC(=C(C=C2)F)F)CSCC(=O)NC3=CC=CC=C3
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Product OPENEYE NAME: ethyl 4-[[(E)-2-cyano-2-(3-pyridylsulfonyl)vinyl]amino]piperidine-1-carboxylate
CAS Name: 4-[[(E)-2-cyano-2-(3-pyridinylsulfonyl)ethenyl]amino]-1-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 4-[[(E)-2-cyano-2-pyridin-3-ylsulfonylethenyl]amino]piperidine-1-carboxylate
SYSTEMATIC NAME: ethyl 4-[[(E)-2-cyano-2-pyridin-3-ylsulfonyl-ethenyl]amino]piperidine-1-carboxylate
MOLECULAR FORMULA: C16H20N4O4S
MOLECULAR WEIGHT: 364.4194
SMILES: CCOC(=O)N1CCC(CC1)N/C=C(\C#N)/S(=O)(=O)C2=CN=CC=C2
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Product OPENEYE NAME: ethyl 4-[[(E)-2-(4-chlorophenyl)sulfonyl-3-oxo-but-1-enyl]amino]piperidine-1-carboxylate
CAS Name: 4-[[(E)-2-(4-chlorophenyl)sulfonyl-3-oxobut-1-enyl]amino]-1-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 4-[[(E)-2-(4-chlorophenyl)sulfonyl-3-oxobut-1-enyl]amino]piperidine-1-carboxylate
SYSTEMATIC NAME: ethyl 4-[[(E)-2-(4-chlorophenyl)sulfonyl-3-oxidanylidene-but-1-enyl]amino]piperidine-1-carboxylate
MOLECULAR FORMULA: C18H23ClN2O5S
MOLECULAR WEIGHT: 414.90362
SMILES: CCOC(=O)N1CCC(CC1)N/C=C(\C(=O)C)/S(=O)(=O)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: [4-[2-tert-butyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-yl]-phenyl-methanone
CAS Name: [4-[2-tert-butyl-5-(trifluoromethyl)-7-pyrazolo[1,5-a]pyrimidinyl]-1-piperazinyl]-phenylmethanone
IUPAC NAME: [4-[2-tert-butyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-yl]-phenylmethanone
SYSTEMATIC NAME: [4-[2-tert-butyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-yl]-phenyl-methanone
MOLECULAR FORMULA: C22H24F3N5O
MOLECULAR WEIGHT: 431.45407
SMILES: CC(C)(C)C1=NN2C(=C1)N=C(C=C2N3CCN(CC3)C(=O)C4=CC=CC=C4)C(F)(F)F
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Product OPENEYE NAME: [4-[2-tert-butyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-yl]-[4-(trifluoromethyl)phenyl]methanone
CAS Name: [4-[2-tert-butyl-5-(trifluoromethyl)-7-pyrazolo[1,5-a]pyrimidinyl]-1-piperazinyl]-[4-(trifluoromethyl)phenyl]methanone
IUPAC NAME: [4-[2-tert-butyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-yl]-[4-(trifluoromethyl)phenyl]methanone
SYSTEMATIC NAME: [4-[2-tert-butyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-yl]-[4-(trifluoromethyl)phenyl]methanone
MOLECULAR FORMULA: C23H23F6N5O
MOLECULAR WEIGHT: 499.452039
SMILES: CC(C)(C)C1=NN2C(=C1)N=C(C=C2N3CCN(CC3)C(=O)C4=CC=C(C=C4)C(F)(F)F)C(F)(F)F
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Product OPENEYE NAME: [4-[2-tert-butyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-yl]-(2-thienyl)methanone
CAS Name: [4-[2-tert-butyl-5-(trifluoromethyl)-7-pyrazolo[1,5-a]pyrimidinyl]-1-piperazinyl]-thiophen-2-ylmethanone
IUPAC NAME: [4-[2-tert-butyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-yl]-thiophen-2-ylmethanone
SYSTEMATIC NAME: [4-[2-tert-butyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-yl]-thiophen-2-yl-methanone
MOLECULAR FORMULA: C20H22F3N5OS
MOLECULAR WEIGHT: 437.48179
SMILES: CC(C)(C)C1=NN2C(=C1)N=C(C=C2N3CCN(CC3)C(=O)C4=CC=CS4)C(F)(F)F
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Product OPENEYE NAME: ethyl 4-[[(E)-2-cyano-2-isopropylsulfonyl-vinyl]amino]piperidine-1-carboxylate
CAS Name: 4-[[(E)-2-cyano-2-propan-2-ylsulfonylethenyl]amino]-1-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 4-[[(E)-2-cyano-2-propan-2-ylsulfonylethenyl]amino]piperidine-1-carboxylate
SYSTEMATIC NAME: ethyl 4-[[(E)-2-cyano-2-propan-2-ylsulfonyl-ethenyl]amino]piperidine-1-carboxylate
MOLECULAR FORMULA: C14H23N3O4S
MOLECULAR WEIGHT: 329.41512
SMILES: CCOC(=O)N1CCC(CC1)N/C=C(\C#N)/S(=O)(=O)C(C)C
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Product OPENEYE NAME: 4-[2-tert-butyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-yl]-N-phenyl-piperazine-1-carboxamide
CAS Name: 4-[2-tert-butyl-5-(trifluoromethyl)-7-pyrazolo[1,5-a]pyrimidinyl]-N-phenyl-1-piperazinecarboxamide
IUPAC NAME: 4-[2-tert-butyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-yl]-N-phenylpiperazine-1-carboxamide
SYSTEMATIC NAME: 4-[2-tert-butyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-yl]-N-phenyl-piperazine-1-carboxamide
MOLECULAR FORMULA: C22H25F3N6O
MOLECULAR WEIGHT: 446.46871
SMILES: CC(C)(C)C1=NN2C(=C1)N=C(C=C2N3CCN(CC3)C(=O)NC4=CC=CC=C4)C(F)(F)F
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Product OPENEYE NAME: 4-[2-tert-butyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-yl]-N-[4-(trifluoromethoxy)phenyl]piperazine-1-carboxamide
CAS Name: 4-[2-tert-butyl-5-(trifluoromethyl)-7-pyrazolo[1,5-a]pyrimidinyl]-N-[4-(trifluoromethoxy)phenyl]-1-piperazinecarboxamide
IUPAC NAME: 4-[2-tert-butyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-yl]-N-[4-(trifluoromethoxy)phenyl]piperazine-1-carboxamide
SYSTEMATIC NAME: 4-[2-tert-butyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-yl]-N-[4-(trifluoromethyloxy)phenyl]piperazine-1-carboxamide
MOLECULAR FORMULA: C23H24F6N6O2
MOLECULAR WEIGHT: 530.466079
SMILES: CC(C)(C)C1=NN2C(=C1)N=C(C=C2N3CCN(CC3)C(=O)NC4=CC=C(C=C4)OC(F)(F)F)C(F)(F)F
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Product OPENEYE NAME: 2-[[5-(2-anilino-2-oxo-ethyl)sulfanyl-4-methyl-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenyl-acetamide
CAS Name: 2-[[5-[(2-anilino-2-oxoethyl)thio]-4-methyl-1,2,4-triazol-3-yl]methylthio]-N-phenylacetamide
IUPAC NAME: 2-[[5-(2-anilino-2-oxoethyl)sulfanyl-4-methyl-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenylacetamide
SYSTEMATIC NAME: 2-[[4-methyl-5-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenyl-ethanamide
MOLECULAR FORMULA: C20H21N5O2S2
MOLECULAR WEIGHT: 427.54304
SMILES: CN1C(=NN=C1SCC(=O)NC2=CC=CC=C2)CSCC(=O)NC3=CC=CC=C3
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Product OPENEYE NAME: 2-[[4-methyl-5-[2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl]sulfanyl-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenyl-acetamide
CAS Name: 2-[[4-methyl-5-[[2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl]thio]-1,2,4-triazol-3-yl]methylthio]-N-phenylacetamide
IUPAC NAME: 2-[[4-methyl-5-[2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl]sulfanyl-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenylacetamide
SYSTEMATIC NAME: 2-[[4-methyl-5-[2-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]amino]ethyl]sulfanyl-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenyl-ethanamide
MOLECULAR FORMULA: C21H20F3N5O3S2
MOLECULAR WEIGHT: 511.54041
SMILES: CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)OC(F)(F)F)CSCC(=O)NC3=CC=CC=C3
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Product OPENEYE NAME: 2-[[5-[2-(4-isopropylanilino)-2-oxo-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenyl-acetamide
CAS Name: 2-[[4-methyl-5-[[2-oxo-2-(4-propan-2-ylanilino)ethyl]thio]-1,2,4-triazol-3-yl]methylthio]-N-phenylacetamide
IUPAC NAME: 2-[[4-methyl-5-[2-oxo-2-(4-propan-2-ylanilino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenylacetamide
SYSTEMATIC NAME: 2-[[4-methyl-5-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]sulfanyl-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenyl-ethanamide
MOLECULAR FORMULA: C23H27N5O2S2
MOLECULAR WEIGHT: 469.62278
SMILES: CC(C)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C)CSCC(=O)NC3=CC=CC=C3
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Product OPENEYE NAME: 2-[[5-[2-(3-chloroanilino)-2-oxo-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenyl-acetamide
CAS Name: 2-[[5-[[2-(3-chloroanilino)-2-oxoethyl]thio]-4-methyl-1,2,4-triazol-3-yl]methylthio]-N-phenylacetamide
IUPAC NAME: 2-[[5-[2-(3-chloroanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenylacetamide
SYSTEMATIC NAME: 2-[[5-[2-[(3-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methylsulfanyl]-N-phenyl-ethanamide
MOLECULAR FORMULA: C20H20ClN5O2S2
MOLECULAR WEIGHT: 461.9881
SMILES: CN1C(=NN=C1SCC(=O)NC2=CC(=CC=C2)Cl)CSCC(=O)NC3=CC=CC=C3
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Product OPENEYE NAME: 1-(3-bromophenyl)ethanone oxime
CAS Name: 1-(3-bromophenyl)ethanone oxime
IUPAC NAME: N-[1-(3-bromophenyl)ethylidene]hydroxylamine
SYSTEMATIC NAME: N-[1-(3-bromophenyl)ethylidene]hydroxylamine
MOLECULAR FORMULA: C8H8BrNO
MOLECULAR WEIGHT: 214.05922
SMILES: CC(=NO)C1=CC(=CC=C1)Br
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Product OPENEYE NAME: 4-chloro-N'-[2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)acetyl]benzohydrazide
CAS Name: 4-chloro-N'-[1-oxo-2-[3-(2-pyrazinyl)-1,2,4-oxadiazol-5-yl]ethyl]benzohydrazide
IUPAC NAME: 4-chloro-N'-[2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)acetyl]benzohydrazide
SYSTEMATIC NAME: 4-chloranyl-N'-[2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)ethanoyl]benzohydrazide
MOLECULAR FORMULA: C15H11ClN6O3
MOLECULAR WEIGHT: 358.73924
SMILES: C1=CC(=CC=C1C(=O)NNC(=O)CC2=NC(=NO2)C3=NC=CN=C3)Cl
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Product OPENEYE NAME: (E)-3-[4-[2-tert-butyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-yl]-2-(2-thienylsulfonyl)prop-2-enenitrile
CAS Name: (E)-3-[4-[2-tert-butyl-5-(trifluoromethyl)-7-pyrazolo[1,5-a]pyrimidinyl]-1-piperazinyl]-2-thiophen-2-ylsulfonyl-2-propenenitrile
IUPAC NAME: (E)-3-[4-[2-tert-butyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-yl]-2-thiophen-2-ylsulfonylprop-2-enenitrile
SYSTEMATIC NAME: (E)-3-[4-[2-tert-butyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-yl]-2-thiophen-2-ylsulfonyl-prop-2-enenitrile
MOLECULAR FORMULA: C22H23F3N6O2S2
MOLECULAR WEIGHT: 524.58223
SMILES: CC(C)(C)C1=NN2C(=C1)N=C(C=C2N3CCN(CC3)/C=C(\C#N)/S(=O)(=O)C4=CC=CS4)C(F)(F)F
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