methyl 2-[2-[(3,4-dichlorophenyl)amino]propanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[2-[(3,4-dichlorophenyl)amino]propanoylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[2-(3,4-dichloroanilino)propanoylamino]-4-methylsulfanyl-butanoate CAS Name: 2-[[2-(3,4-dichloroanilino)-1-oxopropyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[2-(3,4-dichloroanilino)propanoylamino]-4-methylsulfanylbutanoate Traditional Name: 2-[2-(3,4-dichloroanilino)propanoylamino]-4-(methylthio)butyric acid methyl ester Formula: C15H20Cl2N2O3S MolecularWeight: 379.3019

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CCSC)C(=O)OC)NC1=CC(=C(C=C1)Cl)Cl

Isomeric SMILES

CC(C(=O)NC(CCSC)C(=O)OC)NC1=CC(=C(C=C1)Cl)Cl

InChI

InChI=1S/C15H20Cl2N2O3S/c1-9(18-10-4-5-11(16)12(17)8-10)14(20)19-13(6-7-23-3)15(21)22-2/h4-5,8-9,13,18H,6-7H2,1-3H3,(H,19,20)