methyl 4-[[2-(thiophen-2-ylmethylsulfanyl)phenyl]carbonylamino]butanoate

Systemtic Name: methyl 4-[[2-(thiophen-2-ylmethylsulfanyl)phenyl]carbonylamino]butanoate Openeye Name: methyl 4-[[2-(2-thienylmethylsulfanyl)benzoyl]amino]butanoate CAS Name: 4-[[oxo-[2-(thiophen-2-ylmethylthio)phenyl]methyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-(thiophen-2-ylmethylsulfanyl)benzoyl]amino]butanoate Traditional Name: 4-[[2-(2-thenylthio)benzoyl]amino]butyric acid methyl ester Formula: C17H19NO3S2 MolecularWeight: 349.46766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)C1=CC=CC=C1SCC2=CC=CS2

Isomeric SMILES

COC(=O)CCCNC(=O)C1=CC=CC=C1SCC2=CC=CS2

InChI

InChI=1S/C17H19NO3S2/c1-21-16(19)9-4-10-18-17(20)14-7-2-3-8-15(14)23-12-13-6-5-11-22-13/h2-3,5-8,11H,4,9-10,12H2,1H3,(H,18,20)