S-[1-[(3,5-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] carbamothioate

Systemtic Name: S-[1-[(3,5-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] carbamothioate Openeye Name: S-[2-(3,5-dimethylanilino)-1-methyl-2-oxo-ethyl] carbamothioate CAS Name: carbamothioic acid S-[1-(3,5-dimethylanilino)-1-oxopropan-2-yl] ester IUPAC Name: S-[1-(3,5-dimethylanilino)-1-oxopropan-2-yl] carbamothioate Traditional Name: thiocarbamic acid S-[2-(3,5-dimethylanilino)-2-keto-1-methyl-ethyl] ester Formula: C12H16N2O2S MolecularWeight: 252.33264

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O2S/c1-7-4-8(2)6-10(5-7)14-11(15)9(3)17-12(13)16/h4-6,9H,1-3H3,(H2,13,16)(H,14,15)