4-methylsulfonyl-2-[(5-methylthiophen-2-yl)carbonylamino]butanoic acid

Systemtic Name: 4-methylsulfonyl-2-[(5-methylthiophen-2-yl)carbonylamino]butanoic acid Openeye Name: 4-methylsulfonyl-2-[(5-methylthiophene-2-carbonyl)amino]butanoic acid CAS Name: 4-methylsulfonyl-2-[[(5-methyl-2-thiophenyl)-oxomethyl]amino]butanoic acid IUPAC Name: 4-methylsulfonyl-2-[(5-methylthiophene-2-carbonyl)amino]butanoic acid Traditional Name: 4-mesyl-2-[(5-methylthiophene-2-carbonyl)amino]butyric acid Formula: C11H15NO5S2 MolecularWeight: 305.3705

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)NC(CCS(=O)(=O)C)C(=O)O

Isomeric SMILES

CC1=CC=C(S1)C(=O)NC(CCS(=O)(=O)C)C(=O)O

InChI

InChI=1S/C11H15NO5S2/c1-7-3-4-9(18-7)10(13)12-8(11(14)15)5-6-19(2,16)17/h3-4,8H,5-6H2,1-2H3,(H,12,13)(H,14,15)