4-methylsulfonyl-2-(2-thiophen-2-ylethanoylamino)butanoic acid

Systemtic Name: 4-methylsulfonyl-2-(2-thiophen-2-ylethanoylamino)butanoic acid Openeye Name: 4-methylsulfonyl-2-[[2-(2-thienyl)acetyl]amino]butanoic acid CAS Name: 4-methylsulfonyl-2-[(1-oxo-2-thiophen-2-ylethyl)amino]butanoic acid IUPAC Name: 4-methylsulfonyl-2-[(2-thiophen-2-ylacetyl)amino]butanoic acid Traditional Name: 4-mesyl-2-[[2-(2-thienyl)acetyl]amino]butyric acid Formula: C11H15NO5S2 MolecularWeight: 305.3705

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)O)NC(=O)CC1=CC=CS1

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)O)NC(=O)CC1=CC=CS1

InChI

InChI=1S/C11H15NO5S2/c1-19(16,17)6-4-9(11(14)15)12-10(13)7-8-3-2-5-18-8/h2-3,5,9H,4,6-7H2,1H3,(H,12,13)(H,14,15)