methyl 2-[[5-azanyl-4-(2-chlorophenyl)carbonyl-thiophen-2-yl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[[5-azanyl-4-(2-chlorophenyl)carbonyl-thiophen-2-yl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[[5-amino-4-(2-chlorobenzoyl)thiophene-2-carbonyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[[5-amino-4-[(2-chlorophenyl)-oxomethyl]-2-thiophenyl]-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[[5-amino-4-(2-chlorobenzoyl)thiophene-2-carbonyl]amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[5-amino-4-(2-chlorobenzoyl)thiophene-2-carbonyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C18H19ClN2O4S2 MolecularWeight: 426.93746

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)C1=CC(=C(S1)N)C(=O)C2=CC=CC=C2Cl

Isomeric SMILES

COC(=O)C(CCSC)NC(=O)C1=CC(=C(S1)N)C(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C18H19ClN2O4S2/c1-25-18(24)13(7-8-26-2)21-17(23)14-9-11(16(20)27-14)15(22)10-5-3-4-6-12(10)19/h3-6,9,13H,7-8,20H2,1-2H3,(H,21,23)