4-methylsulfonyl-2-(2-thiophen-3-ylethanoylamino)butanoic acid

Systemtic Name: 4-methylsulfonyl-2-(2-thiophen-3-ylethanoylamino)butanoic acid Openeye Name: 4-methylsulfonyl-2-[[2-(3-thienyl)acetyl]amino]butanoic acid CAS Name: 4-methylsulfonyl-2-[[1-oxo-2-(3-thiophenyl)ethyl]amino]butanoic acid IUPAC Name: 4-methylsulfonyl-2-[(2-thiophen-3-ylacetyl)amino]butanoic acid Traditional Name: 4-mesyl-2-[[2-(3-thienyl)acetyl]amino]butyric acid Formula: C11H15NO5S2 MolecularWeight: 305.3705

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)O)NC(=O)CC1=CSC=C1

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)O)NC(=O)CC1=CSC=C1

InChI

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