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

Systemtic Name: 4-methylsulfonyl-2-[(5-methylthiophen-2-yl)sulfonylamino]butanoic acid Openeye Name: 4-methylsulfonyl-2-[(5-methyl-2-thienyl)sulfonylamino]butanoic acid CAS Name: 4-methylsulfonyl-2-[(5-methyl-2-thiophenyl)sulfonylamino]butanoic acid IUPAC Name: 4-methylsulfonyl-2-[(5-methylthiophen-2-yl)sulfonylamino]butanoic acid Traditional Name: 4-mesyl-2-[(5-methyl-2-thienyl)sulfonylamino]butyric acid Formula: C10H15NO6S3 MolecularWeight: 341.4242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H15NO6S3/c1-7-3-4-9(18-7)20(16,17)11-8(10(12)13)5-6-19(2,14)15/h3-4,8,11H,5-6H2,1-2H3,(H,12,13)