2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(4-propan-2-ylphenyl)ethanone

Systemtic Name: 2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(4-propan-2-ylphenyl)ethanone Openeye Name: 1-(4-isopropylphenyl)-2-(1-methyltetrazol-5-yl)sulfanyl-ethanone CAS Name: 2-[(1-methyl-5-tetrazolyl)thio]-1-(4-propan-2-ylphenyl)ethanone IUPAC Name: 2-(1-methyltetrazol-5-yl)sulfanyl-1-(4-propan-2-ylphenyl)ethanone Traditional Name: 2-[(1-methyltetrazol-5-yl)thio]-1-p-cumenyl-ethanone Formula: C13H16N4OS MolecularWeight: 276.35734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)CSC2=NN=NN2C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)CSC2=NN=NN2C

InChI

InChI=1S/C13H16N4OS/c1-9(2)10-4-6-11(7-5-10)12(18)8-19-13-14-15-16-17(13)3/h4-7,9H,8H2,1-3H3