[1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 2-[(2-chlorophenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: [1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 2-[(2-chlorophenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: [2-(allylamino)-1-methyl-2-oxo-ethyl] 2-[(2-chlorobenzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[(2-chlorophenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid [1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(prop-2-enylamino)propan-2-yl] 2-[(2-chlorobenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: 2-[(2-chlorobenzoyl)amino]-4-(methylthio)butyric acid [2-(allylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H23ClN2O4S MolecularWeight: 398.90422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)OC(=O)C(CCSC)NC(=O)C1=CC=CC=C1Cl

Isomeric SMILES

CC(C(=O)NCC=C)OC(=O)C(CCSC)NC(=O)C1=CC=CC=C1Cl

InChI

InChI=1S/C18H23ClN2O4S/c1-4-10-20-16(22)12(2)25-18(24)15(9-11-26-3)21-17(23)13-7-5-6-8-14(13)19/h4-8,12,15H,1,9-11H2,2-3H3,(H,20,22)(H,21,23)