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

Systemtic Name: 1-(4-methylphenyl)-2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propan-1-one Openeye Name: 2-(1-methyltetrazol-5-yl)sulfanyl-1-(p-tolyl)propan-1-one CAS Name: 1-(4-methylphenyl)-2-[(1-methyl-5-tetrazolyl)thio]-1-propanone IUPAC Name: 1-(4-methylphenyl)-2-(1-methyltetrazol-5-yl)sulfanylpropan-1-one Traditional Name: 2-[(1-methyltetrazol-5-yl)thio]-1-(p-tolyl)propan-1-one Formula: C12H14N4OS MolecularWeight: 262.33076

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N4OS/c1-8-4-6-10(7-5-8)11(17)9(2)18-12-13-14-15-16(12)3/h4-7,9H,1-3H3