S-(3-methylsulfanylphenyl) N-(2-methylpropyl)carbamothioate

Systemtic Name: S-(3-methylsulfanylphenyl) N-(2-methylpropyl)carbamothioate Openeye Name: S-(3-methylsulfanylphenyl) N-isobutylcarbamothioate CAS Name: N-(2-methylpropyl)carbamothioic acid S-[3-(methylthio)phenyl] ester IUPAC Name: S-(3-methylsulfanylphenyl) N-(2-methylpropyl)carbamothioate Traditional Name: N-isobutylthiocarbamic acid S-[3-(methylthio)phenyl] ester Formula: C12H17NOS2 MolecularWeight: 255.39948

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)SC1=CC(=CC=C1)SC

Isomeric SMILES

CC(C)CNC(=O)SC1=CC(=CC=C1)SC

InChI

InChI=1S/C12H17NOS2/c1-9(2)8-13-12(14)16-11-6-4-5-10(7-11)15-3/h4-7,9H,8H2,1-3H3,(H,13,14)