2-[2-(4-chlorophenyl)sulfanylethylcarbamothioyl-methyl-amino]-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[2-(4-chlorophenyl)sulfanylethylcarbamothioyl-methyl-amino]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[2-(4-chlorophenyl)sulfanylethylcarbamothioyl-methyl-amino]-N-(p-tolyl)acetamide CAS Name: 2-[[[2-[(4-chlorophenyl)thio]ethylamino]-sulfanylidenemethyl]-methylamino]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[2-(4-chlorophenyl)sulfanylethylcarbamothioyl-methylamino]-N-(4-methylphenyl)acetamide Traditional Name: 2-[2-[(4-chlorophenyl)thio]ethylthiocarbamoyl-methyl-amino]-N-(p-tolyl)acetamide Formula: C19H22ClN3OS2 MolecularWeight: 407.98048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN(C)C(=S)NCCSC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN(C)C(=S)NCCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H22ClN3OS2/c1-14-3-7-16(8-4-14)22-18(24)13-23(2)19(25)21-11-12-26-17-9-5-15(20)6-10-17/h3-10H,11-13H2,1-2H3,(H,21,25)(H,22,24)