S-(3,5-dimethylphenyl) N-carbonocyanidoyl-N-methyl-carbamothioate

Systemtic Name: S-(3,5-dimethylphenyl) N-carbonocyanidoyl-N-methyl-carbamothioate Openeye Name: S-(3,5-dimethylphenyl) N-carbonocyanidoyl-N-methyl-carbamothioate CAS Name: N-carbonocyanidoyl-N-methylcarbamothioic acid S-(3,5-dimethylphenyl) ester IUPAC Name: S-(3,5-dimethylphenyl) N-carbonocyanidoyl-N-methylcarbamothioate Traditional Name: N-carbonocyanidoyl-N-methyl-thiocarbamic acid S-(3,5-dimethylphenyl) ester Formula: C12H12N2O2S MolecularWeight: 248.30088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)SC(=O)N(C)C(=O)C#N)C

Isomeric SMILES

CC1=CC(=CC(=C1)SC(=O)N(C)C(=O)C#N)C

InChI

InChI=1S/C12H12N2O2S/c1-8-4-9(2)6-10(5-8)17-12(16)14(3)11(15)7-13/h4-6H,1-3H3