propan-2-yl 2-[(3-chlorophenyl)carbonylcarbamothioylamino]-4-methylsulfanyl-butanoate

Systemtic Name: propan-2-yl 2-[(3-chlorophenyl)carbonylcarbamothioylamino]-4-methylsulfanyl-butanoate Openeye Name: isopropyl 2-[(3-chlorobenzoyl)carbamothioylamino]-4-methylsulfanyl-butanoate CAS Name: 2-[[[[(3-chlorophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-4-(methylthio)butanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(3-chlorobenzoyl)carbamothioylamino]-4-methylsulfanylbutanoate Traditional Name: 2-[(3-chlorobenzoyl)thiocarbamoylamino]-4-(methylthio)butyric acid isopropyl ester Formula: C16H21ClN2O3S2 MolecularWeight: 388.93254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(CCSC)NC(=S)NC(=O)C1=CC(=CC=C1)Cl

Isomeric SMILES

CC(C)OC(=O)C(CCSC)NC(=S)NC(=O)C1=CC(=CC=C1)Cl

InChI

InChI=1S/C16H21ClN2O3S2/c1-10(2)22-15(21)13(7-8-24-3)18-16(23)19-14(20)11-5-4-6-12(17)9-11/h4-6,9-10,13H,7-8H2,1-3H3,(H2,18,19,20,23)