ethanedioic acid; N-(2-methylsulfanylphenyl)-2-(2-oxidanylpropylamino)ethanamide

Systemtic Name: ethanedioic acid; N-(2-methylsulfanylphenyl)-2-(2-oxidanylpropylamino)ethanamide Openeye Name: 2-(2-hydroxypropylamino)-N-(2-methylsulfanylphenyl)acetamide; oxalic acid CAS Name: 2-(2-hydroxypropylamino)-N-[2-(methylthio)phenyl]acetamide; oxalic acid IUPAC Name: 2-(2-hydroxypropylamino)-N-(2-methylsulfanylphenyl)acetamide; oxalic acid Traditional Name: 2-(2-hydroxypropylamino)-N-[2-(methylthio)phenyl]acetamide; oxalic acid Formula: C14H20N2O6S MolecularWeight: 344.3834

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNCC(=O)NC1=CC=CC=C1SC)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(CNCC(=O)NC1=CC=CC=C1SC)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H18N2O2S.C2H2O4/c1-9(15)7-13-8-12(16)14-10-5-3-4-6-11(10)17-2;3-1(4)2(5)6/h3-6,9,13,15H,7-8H2,1-2H3,(H,14,16);(H,3,4)(H,5,6)