2-[(5-acetamidothiophen-2-yl)carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[(5-acetamidothiophen-2-yl)carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(5-acetamidothiophene-2-carbonyl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[(5-acetamido-2-thiophenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(5-acetamidothiophene-2-carbonyl)amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(5-acetamidothiophene-2-carbonyl)amino]-4-(methylthio)butyric acid Formula: C12H16N2O4S2 MolecularWeight: 316.39644

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(S1)C(=O)NC(CCSC)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC=C(S1)C(=O)NC(CCSC)C(=O)O

InChI

InChI=1S/C12H16N2O4S2/c1-7(15)13-10-4-3-9(20-10)11(16)14-8(12(17)18)5-6-19-2/h3-4,8H,5-6H2,1-2H3,(H,13,15)(H,14,16)(H,17,18)