1-(4-chlorophenyl)-2-[(4-methyl-5-quinolin-6-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(4-chlorophenyl)-2-[(4-methyl-5-quinolin-6-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(4-chlorophenyl)-2-[[4-methyl-5-(6-quinolyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(4-chlorophenyl)-2-[[4-methyl-5-(6-quinolinyl)-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(4-chlorophenyl)-2-[(4-methyl-5-quinolin-6-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(4-chlorophenyl)-2-[[4-methyl-5-(6-quinolyl)-1,2,4-triazol-3-yl]thio]ethanone Formula: C20H15ClN4OS MolecularWeight: 394.8773

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)Cl)C3=CC4=C(C=C3)N=CC=C4

Isomeric SMILES

CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)Cl)C3=CC4=C(C=C3)N=CC=C4

InChI

InChI=1S/C20H15ClN4OS/c1-25-19(15-6-9-17-14(11-15)3-2-10-22-17)23-24-20(25)27-12-18(26)13-4-7-16(21)8-5-13/h2-11H,12H2,1H3