methyl 2-[4-[2-(4-methylphenyl)sulfanylethylcarbamothioylamino]phenyl]ethanoate

Systemtic Name: methyl 2-[4-[2-(4-methylphenyl)sulfanylethylcarbamothioylamino]phenyl]ethanoate Openeye Name: methyl 2-[4-[2-(p-tolylsulfanyl)ethylcarbamothioylamino]phenyl]acetate CAS Name: 2-[4-[[[2-[(4-methylphenyl)thio]ethylamino]-sulfanylidenemethyl]amino]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[2-(4-methylphenyl)sulfanylethylcarbamothioylamino]phenyl]acetate Traditional Name: 2-[4-[2-(p-tolylthio)ethylthiocarbamoylamino]phenyl]acetic acid methyl ester Formula: C19H22N2O2S2 MolecularWeight: 374.52018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=S)NC2=CC=C(C=C2)CC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=S)NC2=CC=C(C=C2)CC(=O)OC

InChI

InChI=1S/C19H22N2O2S2/c1-14-3-9-17(10-4-14)25-12-11-20-19(24)21-16-7-5-15(6-8-16)13-18(22)23-2/h3-10H,11-13H2,1-2H3,(H2,20,21,24)