1-[3-(4-chlorophenyl)-5-methylsulfanyl-1,2,4-triazol-1-yl]-2-phenyl-ethanone

Systemtic Name: 1-[3-(4-chlorophenyl)-5-methylsulfanyl-1,2,4-triazol-1-yl]-2-phenyl-ethanone Openeye Name: 1-[3-(4-chlorophenyl)-5-methylsulfanyl-1,2,4-triazol-1-yl]-2-phenyl-ethanone CAS Name: 1-[3-(4-chlorophenyl)-5-(methylthio)-1,2,4-triazol-1-yl]-2-phenylethanone IUPAC Name: 1-[3-(4-chlorophenyl)-5-methylsulfanyl-1,2,4-triazol-1-yl]-2-phenylethanone Traditional Name: 1-[3-(4-chlorophenyl)-5-(methylthio)-1,2,4-triazol-1-yl]-2-phenyl-ethanone Formula: C17H14ClN3OS MolecularWeight: 343.83056

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NN1C(=O)CC2=CC=CC=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CSC1=NC(=NN1C(=O)CC2=CC=CC=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H14ClN3OS/c1-23-17-19-16(13-7-9-14(18)10-8-13)20-21(17)15(22)11-12-5-3-2-4-6-12/h2-10H,11H2,1H3