ethyl 4-[2-(4-acetamidophenyl)sulfanylethanoylamino]butanoate

Systemtic Name: ethyl 4-[2-(4-acetamidophenyl)sulfanylethanoylamino]butanoate Openeye Name: ethyl 4-[[2-(4-acetamidophenyl)sulfanylacetyl]amino]butanoate CAS Name: 4-[[2-[(4-acetamidophenyl)thio]-1-oxoethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(4-acetamidophenyl)sulfanylacetyl]amino]butanoate Traditional Name: 4-[[2-[(4-acetamidophenyl)thio]acetyl]amino]butyric acid ethyl ester Formula: C16H22N2O4S MolecularWeight: 338.42188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC(=O)CSC1=CC=C(C=C1)NC(=O)C

Isomeric SMILES

CCOC(=O)CCCNC(=O)CSC1=CC=C(C=C1)NC(=O)C

InChI

InChI=1S/C16H22N2O4S/c1-3-22-16(21)5-4-10-17-15(20)11-23-14-8-6-13(7-9-14)18-12(2)19/h6-9H,3-5,10-11H2,1-2H3,(H,17,20)(H,18,19)