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

Systemtic Name: 2-[[1-(3-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-1-phenyl-ethanone Openeye Name: 2-[1-(m-tolyl)tetrazol-5-yl]sulfanyl-1-phenyl-ethanone CAS Name: 2-[[1-(3-methylphenyl)-5-tetrazolyl]thio]-1-phenylethanone IUPAC Name: 2-[1-(3-methylphenyl)tetrazol-5-yl]sulfanyl-1-phenylethanone Traditional Name: 2-[[1-(m-tolyl)tetrazol-5-yl]thio]-1-phenyl-ethanone Formula: C16H14N4OS MolecularWeight: 310.37356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=N2)SCC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=N2)SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H14N4OS/c1-12-6-5-9-14(10-12)20-16(17-18-19-20)22-11-15(21)13-7-3-2-4-8-13/h2-10H,11H2,1H3