5-(4-chlorophenyl)-4-ethyl-2-[(6-methylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)methyl]-1,2,4-triazole-3-thione

Systemtic Name: 5-(4-chlorophenyl)-4-ethyl-2-[(6-methylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 5-(4-chlorophenyl)-4-ethyl-2-[(6-methylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)methyl]-1,2,4-triazole-3-thione CAS Name: 5-(4-chlorophenyl)-4-ethyl-2-[(6-methylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)methyl]-1,2,4-triazole-3-thione IUPAC Name: 5-(4-chlorophenyl)-4-ethyl-2-[(6-methylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 5-(4-chlorophenyl)-4-ethyl-2-[(6-mesyl-3,4-dihydro-2H-quinolin-1-yl)methyl]-1,2,4-triazole-3-thione Formula: C21H23ClN4O2S2 MolecularWeight: 463.01592

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CN2CCCC3=C2C=CC(=C3)S(=O)(=O)C)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCN1C(=NN(C1=S)CN2CCCC3=C2C=CC(=C3)S(=O)(=O)C)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H23ClN4O2S2/c1-3-25-20(15-6-8-17(22)9-7-15)23-26(21(25)29)14-24-12-4-5-16-13-18(30(2,27)28)10-11-19(16)24/h6-11,13H,3-5,12,14H2,1-2H3