Product OPENEYE NAME: N-(2-phenylethyl)-1,2,3-benzothiadiazole-5-carboxamide
CAS Name: N-(2-phenylethyl)-1,2,3-benzothiadiazole-5-carboxamide
IUPAC NAME: N-(2-phenylethyl)-1,2,3-benzothiadiazole-5-carboxamide
SYSTEMATIC NAME: N-(2-phenylethyl)-1,2,3-benzothiadiazole-5-carboxamide
MOLECULAR FORMULA: C15H13N3OS
MOLECULAR WEIGHT: 283.34822
SMILES: C1=CC=C(C=C1)CCNC(=O)C2=CC3=C(C=C2)SN=N3
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Product OPENEYE NAME: N-(4-pyridylmethyl)-1,2,3-benzothiadiazole-5-carboxamide
CAS Name: N-(pyridin-4-ylmethyl)-1,2,3-benzothiadiazole-5-carboxamide
IUPAC NAME: N-(pyridin-4-ylmethyl)-1,2,3-benzothiadiazole-5-carboxamide
SYSTEMATIC NAME: N-(pyridin-4-ylmethyl)-1,2,3-benzothiadiazole-5-carboxamide
MOLECULAR FORMULA: C13H10N4OS
MOLECULAR WEIGHT: 270.3097
SMILES: C1=CC2=C(C=C1C(=O)NCC3=CC=NC=C3)N=NS2
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Product OPENEYE NAME: 2-[4-[8-fluoro-2-(trifluoromethyl)-4-quinolyl]piperazin-1-yl]ethanol
CAS Name: 2-[4-[8-fluoro-2-(trifluoromethyl)-4-quinolinyl]-1-piperazinyl]ethanol
IUPAC NAME: 2-[4-[8-fluoro-2-(trifluoromethyl)quinolin-4-yl]piperazin-1-yl]ethanol
SYSTEMATIC NAME: 2-[4-[8-fluoranyl-2-(trifluoromethyl)quinolin-4-yl]piperazin-1-yl]ethanol
MOLECULAR FORMULA: C16H17F4N3O
MOLECULAR WEIGHT: 343.319293
SMILES: C1CN(CCN1CCO)C2=CC(=NC3=C2C=CC=C3F)C(F)(F)F
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Product OPENEYE NAME: 2-[[4-allyl-5-(6-quinolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-benzyl-acetamide
CAS Name: N-(phenylmethyl)-2-[[4-prop-2-enyl-5-(6-quinolinyl)-1,2,4-triazol-3-yl]thio]acetamide
IUPAC NAME: N-benzyl-2-[(4-prop-2-enyl-5-quinolin-6-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
SYSTEMATIC NAME: N-(phenylmethyl)-2-[(4-prop-2-enyl-5-quinolin-6-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide
MOLECULAR FORMULA: C23H21N5OS
MOLECULAR WEIGHT: 415.51074
SMILES: C=CCN1C(=NN=C1SCC(=O)NCC2=CC=CC=C2)C3=CC4=C(C=C3)N=CC=C4
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Product OPENEYE NAME: 6-[4-allyl-5-[(4-chlorophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]quinoline
CAS Name: 6-[5-[(4-chlorophenyl)methylthio]-4-prop-2-enyl-1,2,4-triazol-3-yl]quinoline
IUPAC NAME: 6-[5-[(4-chlorophenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]quinoline
SYSTEMATIC NAME: 6-[5-[(4-chlorophenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]quinoline
MOLECULAR FORMULA: C21H17ClN4S
MOLECULAR WEIGHT: 392.90448
SMILES: C=CCN1C(=NN=C1SCC2=CC=C(C=C2)Cl)C3=CC4=C(C=C3)N=CC=C4
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Product OPENEYE NAME: 2-[[4-allyl-5-(6-quinolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-isopropyl-acetamide
CAS Name: N-propan-2-yl-2-[[4-prop-2-enyl-5-(6-quinolinyl)-1,2,4-triazol-3-yl]thio]acetamide
IUPAC NAME: N-propan-2-yl-2-[(4-prop-2-enyl-5-quinolin-6-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
SYSTEMATIC NAME: N-propan-2-yl-2-[(4-prop-2-enyl-5-quinolin-6-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide
MOLECULAR FORMULA: C19H21N5OS
MOLECULAR WEIGHT: 367.46794
SMILES: CC(C)NC(=O)CSC1=NN=C(N1CC=C)C2=CC3=C(C=C2)N=CC=C3
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Product OPENEYE NAME: 2-[[4-allyl-5-(6-quinolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-acetamide
CAS Name: N-phenyl-2-[[4-prop-2-enyl-5-(6-quinolinyl)-1,2,4-triazol-3-yl]thio]acetamide
IUPAC NAME: N-phenyl-2-[(4-prop-2-enyl-5-quinolin-6-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
SYSTEMATIC NAME: N-phenyl-2-[(4-prop-2-enyl-5-quinolin-6-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide
MOLECULAR FORMULA: C22H19N5OS
MOLECULAR WEIGHT: 401.48416
SMILES: C=CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2)C3=CC4=C(C=C3)N=CC=C4
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Product OPENEYE NAME: 6-(4-allyl-5-benzylsulfanyl-1,2,4-triazol-3-yl)quinoline
CAS Name: 6-[5-(phenylmethylthio)-4-prop-2-enyl-1,2,4-triazol-3-yl]quinoline
IUPAC NAME: 6-(5-benzylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)quinoline
SYSTEMATIC NAME: 6-[5-(phenylmethylsulfanyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]quinoline
MOLECULAR FORMULA: C21H18N4S
MOLECULAR WEIGHT: 358.45942
SMILES: C=CCN1C(=NN=C1SCC2=CC=CC=C2)C3=CC4=C(C=C3)N=CC=C4
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Product OPENEYE NAME: ethyl 2-[[4-methyl-5-(6-quinolyl)-1,2,4-triazol-3-yl]sulfanyl]acetate
CAS Name: 2-[[4-methyl-5-(6-quinolinyl)-1,2,4-triazol-3-yl]thio]acetic acid ethyl ester
IUPAC NAME: ethyl 2-[(4-methyl-5-quinolin-6-yl-1,2,4-triazol-3-yl)sulfanyl]acetate
SYSTEMATIC NAME: ethyl 2-[(4-methyl-5-quinolin-6-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoate
MOLECULAR FORMULA: C16H16N4O2S
MOLECULAR WEIGHT: 328.38884
SMILES: CCOC(=O)CSC1=NN=C(N1C)C2=CC3=C(C=C2)N=CC=C3
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Product OPENEYE NAME: 4-[(1-benzyl-4-piperidyl)oxy]-8-fluoro-2-(trifluoromethyl)quinoline
CAS Name: 8-fluoro-4-[[1-(phenylmethyl)-4-piperidinyl]oxy]-2-(trifluoromethyl)quinoline
IUPAC NAME: 4-(1-benzylpiperidin-4-yl)oxy-8-fluoro-2-(trifluoromethyl)quinoline
SYSTEMATIC NAME: 8-fluoranyl-4-[1-(phenylmethyl)piperidin-4-yl]oxy-2-(trifluoromethyl)quinoline
MOLECULAR FORMULA: C22H20F4N2O
MOLECULAR WEIGHT: 404.400613
SMILES: C1CN(CCC1OC2=CC(=NC3=C2C=CC=C3F)C(F)(F)F)CC4=CC=CC=C4
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Product OPENEYE NAME: [1-[5,7-dichloro-2-(trifluoromethyl)-4-quinolyl]-4-piperidyl] acetate
CAS Name: acetic acid [1-[5,7-dichloro-2-(trifluoromethyl)-4-quinolinyl]-4-piperidinyl] ester
IUPAC NAME: [1-[5,7-dichloro-2-(trifluoromethyl)quinolin-4-yl]piperidin-4-yl] acetate
SYSTEMATIC NAME: [1-[5,7-bis(chloranyl)-2-(trifluoromethyl)quinolin-4-yl]piperidin-4-yl] ethanoate
MOLECULAR FORMULA: C17H15Cl2F3N2O2
MOLECULAR WEIGHT: 407.21441
SMILES: CC(=O)OC1CCN(CC1)C2=CC(=NC3=CC(=CC(=C32)Cl)Cl)C(F)(F)F
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Product OPENEYE NAME: 1-[5,7-dichloro-2-(trifluoromethyl)-4-quinolyl]piperidin-4-ol
CAS Name: 1-[5,7-dichloro-2-(trifluoromethyl)-4-quinolinyl]-4-piperidinol
IUPAC NAME: 1-[5,7-dichloro-2-(trifluoromethyl)quinolin-4-yl]piperidin-4-ol
SYSTEMATIC NAME: 1-[5,7-bis(chloranyl)-2-(trifluoromethyl)quinolin-4-yl]piperidin-4-ol
MOLECULAR FORMULA: C15H13Cl2F3N2O
MOLECULAR WEIGHT: 365.17773
SMILES: C1CN(CCC1O)C2=CC(=NC3=CC(=CC(=C32)Cl)Cl)C(F)(F)F
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Product OPENEYE NAME: 2-[4-[8-fluoro-2-(trifluoromethyl)-4-quinolyl]piperazin-1-yl]ethyl 2,2,2-trifluoroacetate
CAS Name: 2,2,2-trifluoroacetic acid 2-[4-[8-fluoro-2-(trifluoromethyl)-4-quinolinyl]-1-piperazinyl]ethyl ester
IUPAC NAME: 2-[4-[8-fluoro-2-(trifluoromethyl)quinolin-4-yl]piperazin-1-yl]ethyl 2,2,2-trifluoroacetate
SYSTEMATIC NAME: 2-[4-[8-fluoranyl-2-(trifluoromethyl)quinolin-4-yl]piperazin-1-yl]ethyl 2,2,2-tris(fluoranyl)ethanoate
MOLECULAR FORMULA: C18H16F7N3O2
MOLECULAR WEIGHT: 439.327362
SMILES: C1CN(CCN1CCOC(=O)C(F)(F)F)C2=CC(=NC3=C2C=CC=C3F)C(F)(F)F
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Product OPENEYE NAME: ethyl 1-[8-fluoro-2-(trifluoromethyl)-4-quinolyl]piperidine-4-carboxylate
CAS Name: 1-[8-fluoro-2-(trifluoromethyl)-4-quinolinyl]-4-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 1-[8-fluoro-2-(trifluoromethyl)quinolin-4-yl]piperidine-4-carboxylate
SYSTEMATIC NAME: ethyl 1-[8-fluoranyl-2-(trifluoromethyl)quinolin-4-yl]piperidine-4-carboxylate
MOLECULAR FORMULA: C18H18F4N2O2
MOLECULAR WEIGHT: 370.341333
SMILES: CCOC(=O)C1CCN(CC1)C2=CC(=NC3=C2C=CC=C3F)C(F)(F)F
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Product OPENEYE NAME: 6-[4-allyl-5-[[4-(trifluoromethoxy)phenyl]methylsulfanyl]-1,2,4-triazol-3-yl]quinoline
CAS Name: 6-[4-prop-2-enyl-5-[[4-(trifluoromethoxy)phenyl]methylthio]-1,2,4-triazol-3-yl]quinoline
IUPAC NAME: 6-[4-prop-2-enyl-5-[[4-(trifluoromethoxy)phenyl]methylsulfanyl]-1,2,4-triazol-3-yl]quinoline
SYSTEMATIC NAME: 6-[4-prop-2-enyl-5-[[4-(trifluoromethyloxy)phenyl]methylsulfanyl]-1,2,4-triazol-3-yl]quinoline
MOLECULAR FORMULA: C22H17F3N4OS
MOLECULAR WEIGHT: 442.45679
SMILES: C=CCN1C(=NN=C1SCC2=CC=C(C=C2)OC(F)(F)F)C3=CC4=C(C=C3)N=CC=C4
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Product OPENEYE NAME: 6-[4-allyl-5-[(2,6-dichlorophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]quinoline
CAS Name: 6-[5-[(2,6-dichlorophenyl)methylthio]-4-prop-2-enyl-1,2,4-triazol-3-yl]quinoline
IUPAC NAME: 6-[5-[(2,6-dichlorophenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]quinoline
SYSTEMATIC NAME: 6-[5-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]quinoline
MOLECULAR FORMULA: C21H16Cl2N4S
MOLECULAR WEIGHT: 427.34954
SMILES: C=CCN1C(=NN=C1SCC2=C(C=CC=C2Cl)Cl)C3=CC4=C(C=C3)N=CC=C4
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Product OPENEYE NAME: 4-[5-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]tetrazol-1-yl]phenol
CAS Name: 4-[5-[(2-chloro-6-fluorophenyl)methylthio]-1-tetrazolyl]phenol
IUPAC NAME: 4-[5-[(2-chloro-6-fluorophenyl)methylsulfanyl]tetrazol-1-yl]phenol
SYSTEMATIC NAME: 4-[5-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-1,2,3,4-tetrazol-1-yl]phenol
MOLECULAR FORMULA: C14H10ClFN4OS
MOLECULAR WEIGHT: 336.771803
SMILES: C1=CC(=C(C(=C1)Cl)CSC2=NN=NN2C3=CC=C(C=C3)O)F
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Product OPENEYE NAME: N-benzyl-3-nitro-pyridin-2-amine
CAS Name: 3-nitro-N-(phenylmethyl)-2-pyridinamine
IUPAC NAME: N-benzyl-3-nitropyridin-2-amine
SYSTEMATIC NAME: 3-nitro-N-(phenylmethyl)pyridin-2-amine
MOLECULAR FORMULA: C12H11N3O2
MOLECULAR WEIGHT: 229.23464
SMILES: C1=CC=C(C=C1)CNC2=C(C=CC=N2)[N+](=O)[O-]
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Product OPENEYE NAME: N-[3,5-bis(trifluoromethyl)phenyl]-5-(2-methylsulfanylpyrimidin-4-yl)thiophene-2-sulfonamide
CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-5-[2-(methylthio)-4-pyrimidinyl]-2-thiophenesulfonamide
IUPAC NAME: N-[3,5-bis(trifluoromethyl)phenyl]-5-(2-methylsulfanylpyrimidin-4-yl)thiophene-2-sulfonamide
SYSTEMATIC NAME: N-[3,5-bis(trifluoromethyl)phenyl]-5-(2-methylsulfanylpyrimidin-4-yl)thiophene-2-sulfonamide
MOLECULAR FORMULA: C17H11F6N3O2S3
MOLECULAR WEIGHT: 499.473559
SMILES: CSC1=NC=CC(=N1)C2=CC=C(S2)S(=O)(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F
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