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

Systemtic Name: 2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(4-propan-2-ylphenyl)ethanone Openeye Name: 1-(4-isopropylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanyl-ethanone CAS Name: 2-[(1-phenyl-5-tetrazolyl)thio]-1-(4-propan-2-ylphenyl)ethanone IUPAC Name: 2-(1-phenyltetrazol-5-yl)sulfanyl-1-(4-propan-2-ylphenyl)ethanone Traditional Name: 1-p-cumenyl-2-[(1-phenyltetrazol-5-yl)thio]ethanone Formula: C18H18N4OS MolecularWeight: 338.42672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4OS/c1-13(2)14-8-10-15(11-9-14)17(23)12-24-18-19-20-21-22(18)16-6-4-3-5-7-16/h3-11,13H,12H2,1-2H3