2-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(4-methylphenyl)propan-1-one

Systemtic Name: 2-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(4-methylphenyl)propan-1-one Openeye Name: 2-(1-tert-butyltetrazol-5-yl)sulfanyl-1-(p-tolyl)propan-1-one CAS Name: 2-[(1-tert-butyl-5-tetrazolyl)thio]-1-(4-methylphenyl)-1-propanone IUPAC Name: 2-(1-tert-butyltetrazol-5-yl)sulfanyl-1-(4-methylphenyl)propan-1-one Traditional Name: 2-[(1-tert-butyltetrazol-5-yl)thio]-1-(p-tolyl)propan-1-one Formula: C15H20N4OS MolecularWeight: 304.4105

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)SC2=NN=NN2C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(C)SC2=NN=NN2C(C)(C)C

InChI

InChI=1S/C15H20N4OS/c1-10-6-8-12(9-7-10)13(20)11(2)21-14-16-17-18-19(14)15(3,4)5/h6-9,11H,1-5H3