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

Systemtic Name: [3-(4-chlorophenyl)-5-methylsulfanyl-1,2,4-triazol-1-yl]-phenyl-methanone Openeye Name: [3-(4-chlorophenyl)-5-methylsulfanyl-1,2,4-triazol-1-yl]-phenyl-methanone CAS Name: [3-(4-chlorophenyl)-5-(methylthio)-1,2,4-triazol-1-yl]-phenylmethanone IUPAC Name: [3-(4-chlorophenyl)-5-methylsulfanyl-1,2,4-triazol-1-yl]-phenylmethanone Traditional Name: [3-(4-chlorophenyl)-5-(methylthio)-1,2,4-triazol-1-yl]-phenyl-methanone Formula: C16H12ClN3OS MolecularWeight: 329.80398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12ClN3OS/c1-22-16-18-14(11-7-9-13(17)10-8-11)19-20(16)15(21)12-5-3-2-4-6-12/h2-10H,1H3