2-(2-hydroxyethyl)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-4-sulfanyl-butanoic acid

Systemtic Name: 2-(2-hydroxyethyl)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-4-sulfanyl-butanoic acid Openeye Name: 2-(2-hydroxyethyl)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-4-sulfanyl-butanoic acid CAS Name: 2-(2-hydroxyethyl)-4-mercapto-2-[(4-methoxyphenyl)sulfonylamino]-3-methylbutanoic acid IUPAC Name: 2-(2-hydroxyethyl)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-4-sulfanylbutanoic acid Traditional Name: 2-(2-hydroxyethyl)-4-mercapto-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butyric acid Formula: C14H21NO6S2 MolecularWeight: 363.44964

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)C(CCO)(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)OC

Isomeric SMILES

CC(CS)C(CCO)(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)OC

InChI

InChI=1S/C14H21NO6S2/c1-10(9-22)14(7-8-16,13(17)18)15-23(19,20)12-5-3-11(21-2)4-6-12/h3-6,10,15-16,22H,7-9H2,1-2H3,(H,17,18)