2-[[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-1-(4-methylphenyl)ethanone

Systemtic Name: 2-[[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-1-(4-methylphenyl)ethanone Openeye Name: 2-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanyl-1-(p-tolyl)ethanone CAS Name: 2-[[1-(4-chlorophenyl)-5-tetrazolyl]thio]-1-(4-methylphenyl)ethanone IUPAC Name: 2-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanyl-1-(4-methylphenyl)ethanone Traditional Name: 2-[[1-(4-chlorophenyl)tetrazol-5-yl]thio]-1-(p-tolyl)ethanone Formula: C16H13ClN4OS MolecularWeight: 344.81862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NN=NN2C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NN=NN2C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN4OS/c1-11-2-4-12(5-3-11)15(22)10-23-16-18-19-20-21(16)14-8-6-13(17)7-9-14/h2-9H,10H2,1H3