methyl 4-[(4-chlorophenyl)sulfanyl-ethanoyl-amino]butanoate

Systemtic Name: methyl 4-[(4-chlorophenyl)sulfanyl-ethanoyl-amino]butanoate Openeye Name: methyl 4-[acetyl-(4-chlorophenyl)sulfanyl-amino]butanoate CAS Name: 4-[acetyl-[(4-chlorophenyl)thio]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[acetyl-(4-chlorophenyl)sulfanylamino]butanoate Traditional Name: 4-[acetyl-[(4-chlorophenyl)thio]amino]butyric acid methyl ester Formula: C13H16ClNO3S MolecularWeight: 301.78904

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CCCC(=O)OC)SC1=CC=C(C=C1)Cl

Isomeric SMILES

CC(=O)N(CCCC(=O)OC)SC1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H16ClNO3S/c1-10(16)15(9-3-4-13(17)18-2)19-12-7-5-11(14)6-8-12/h5-8H,3-4,9H2,1-2H3