methyl 3-[[4-(methylsulfanylmethyl)phenyl]carbonylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[[4-(methylsulfanylmethyl)phenyl]carbonylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[[4-(methylsulfanylmethyl)benzoyl]amino]-3-(2-thienyl)propanoate CAS Name: 3-[[[4-[(methylthio)methyl]phenyl]-oxomethyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[[4-(methylsulfanylmethyl)benzoyl]amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[[4-[(methylthio)methyl]benzoyl]amino]-3-(2-thienyl)propionic acid methyl ester Formula: C17H19NO3S2 MolecularWeight: 349.46766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CS1)NC(=O)C2=CC=C(C=C2)CSC

Isomeric SMILES

COC(=O)CC(C1=CC=CS1)NC(=O)C2=CC=C(C=C2)CSC

InChI

InChI=1S/C17H19NO3S2/c1-21-16(19)10-14(15-4-3-9-23-15)18-17(20)13-7-5-12(6-8-13)11-22-2/h3-9,14H,10-11H2,1-2H3,(H,18,20)