[1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 2-[(2-chlorophenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: [1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 2-[(2-chlorophenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: [2-(tert-butylamino)-1-methyl-2-oxo-ethyl] 2-[(2-chlorobenzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[(2-chlorophenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid [1-(tert-butylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(tert-butylamino)-1-oxopropan-2-yl] 2-[(2-chlorobenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: 2-[(2-chlorobenzoyl)amino]-4-(methylthio)butyric acid [2-(tert-butylamino)-2-keto-1-methyl-ethyl] ester Formula: C19H27ClN2O4S MolecularWeight: 414.94668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27ClN2O4S/c1-12(16(23)22-19(2,3)4)26-18(25)15(10-11-27-5)21-17(24)13-8-6-7-9-14(13)20/h6-9,12,15H,10-11H2,1-5H3,(H,21,24)(H,22,23)