1-[2,4,6-trimethyl-3-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]phenyl]ethanone

Systemtic Name: 1-[2,4,6-trimethyl-3-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]phenyl]ethanone Openeye Name: 1-[2,4,6-trimethyl-3-[(1-phenyltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone CAS Name: 1-[2,4,6-trimethyl-3-[[(1-phenyl-5-tetrazolyl)thio]methyl]phenyl]ethanone IUPAC Name: 1-[2,4,6-trimethyl-3-[(1-phenyltetrazol-5-yl)sulfanylmethyl]phenyl]ethanone Traditional Name: 1-[2,4,6-trimethyl-3-[[(1-phenyltetrazol-5-yl)thio]methyl]phenyl]ethanone Formula: C19H20N4OS MolecularWeight: 352.4533

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C(=O)C)C)CSC2=NN=NN2C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1C(=O)C)C)CSC2=NN=NN2C3=CC=CC=C3)C

InChI

InChI=1S/C19H20N4OS/c1-12-10-13(2)18(15(4)24)14(3)17(12)11-25-19-20-21-22-23(19)16-8-6-5-7-9-16/h5-10H,11H2,1-4H3