(3-azanyl-3-oxidanylidene-propyl) 2-[(2,4-dichlorophenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (3-azanyl-3-oxidanylidene-propyl) 2-[(2,4-dichlorophenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: (3-amino-3-oxo-propyl) 2-[(2,4-dichlorobenzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[(2,4-dichlorophenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid (3-amino-3-oxopropyl) ester IUPAC Name: (3-amino-3-oxopropyl) 2-[(2,4-dichlorobenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: 2-[(2,4-dichlorobenzoyl)amino]-4-(methylthio)butyric acid (3-amino-3-keto-propyl) ester Formula: C15H18Cl2N2O4S MolecularWeight: 393.28542

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OCCC(=O)N)NC(=O)C1=C(C=C(C=C1)Cl)Cl

Isomeric SMILES

CSCCC(C(=O)OCCC(=O)N)NC(=O)C1=C(C=C(C=C1)Cl)Cl

InChI

InChI=1S/C15H18Cl2N2O4S/c1-24-7-5-12(15(22)23-6-4-13(18)20)19-14(21)10-3-2-9(16)8-11(10)17/h2-3,8,12H,4-7H2,1H3,(H2,18,20)(H,19,21)