(phenylmethyl) N-methyl-N-[2-[methyl-(phenylmethylsulfanyl)carbothioyl-amino]ethyl]carbamodithioate

Systemtic Name: (phenylmethyl) N-methyl-N-[2-[methyl-(phenylmethylsulfanyl)carbothioyl-amino]ethyl]carbamodithioate Openeye Name: benzyl N-[2-[benzylsulfanylcarbothioyl(methyl)amino]ethyl]-N-methyl-carbamodithioate CAS Name: N-methyl-N-[2-[methyl-[(phenylmethylthio)-sulfanylidenemethyl]amino]ethyl]carbamodithioic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-[benzylsulfanylcarbothioyl(methyl)amino]ethyl]-N-methylcarbamodithioate Traditional Name: N-[2-[(benzylthio)carbothioyl-methyl-amino]ethyl]-N-methyl-carbamodithioic acid benzyl ester Formula: C20H24N2S4 MolecularWeight: 420.67796

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCN(C)C(=S)SCC1=CC=CC=C1)C(=S)SCC2=CC=CC=C2

Isomeric SMILES

CN(CCN(C)C(=S)SCC1=CC=CC=C1)C(=S)SCC2=CC=CC=C2

InChI

InChI=1S/C20H24N2S4/c1-21(19(23)25-15-17-9-5-3-6-10-17)13-14-22(2)20(24)26-16-18-11-7-4-8-12-18/h3-12H,13-16H2,1-2H3