2-[ethyl-[(4-methylphenyl)sulfonylamino]amino]-4-sulfanyl-butanoic acid

Systemtic Name: 2-[ethyl-[(4-methylphenyl)sulfonylamino]amino]-4-sulfanyl-butanoic acid Openeye Name: 2-[ethyl-(p-tolylsulfonylamino)amino]-4-sulfanyl-butanoic acid CAS Name: 2-[ethyl-[(4-methylphenyl)sulfonylamino]amino]-4-mercaptobutanoic acid IUPAC Name: 2-[ethyl-[(4-methylphenyl)sulfonylamino]amino]-4-sulfanylbutanoic acid Traditional Name: 2-[ethyl-(tosylamino)amino]-4-mercapto-butyric acid Formula: C13H20N2O4S2 MolecularWeight: 332.4389

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(CCS)C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCN(C(CCS)C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C13H20N2O4S2/c1-3-15(12(8-9-20)13(16)17)14-21(18,19)11-6-4-10(2)5-7-11/h4-7,12,14,20H,3,8-9H2,1-2H3,(H,16,17)