4-methylsulfonyl-2-[(3-methylthiophen-2-yl)carbonylamino]butanoic acid

Systemtic Name: 4-methylsulfonyl-2-[(3-methylthiophen-2-yl)carbonylamino]butanoic acid Openeye Name: 4-methylsulfonyl-2-[(3-methylthiophene-2-carbonyl)amino]butanoic acid CAS Name: 4-methylsulfonyl-2-[[(3-methyl-2-thiophenyl)-oxomethyl]amino]butanoic acid IUPAC Name: 4-methylsulfonyl-2-[(3-methylthiophene-2-carbonyl)amino]butanoic acid Traditional Name: 4-mesyl-2-[(3-methylthiophene-2-carbonyl)amino]butyric acid Formula: C11H15NO5S2 MolecularWeight: 305.3705

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)NC(CCS(=O)(=O)C)C(=O)O

Isomeric SMILES

CC1=C(SC=C1)C(=O)NC(CCS(=O)(=O)C)C(=O)O

InChI

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