4-[(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(3-cyano-4-ethyl-5-methyl-2-thienyl)amino]-4-oxo-butanoic acid CAS Name: 4-[(3-cyano-4-ethyl-5-methyl-2-thiophenyl)amino]-4-oxobutanoic acid IUPAC Name: 4-[(3-cyano-4-ethyl-5-methylthiophen-2-yl)amino]-4-oxobutanoic acid Traditional Name: 4-[(3-cyano-4-ethyl-5-methyl-2-thienyl)amino]-4-keto-butyric acid Formula: C12H14N2O3S MolecularWeight: 266.31616

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C#N)NC(=O)CCC(=O)O)C

Isomeric SMILES

CCC1=C(SC(=C1C#N)NC(=O)CCC(=O)O)C

InChI

InChI=1S/C12H14N2O3S/c1-3-8-7(2)18-12(9(8)6-13)14-10(15)4-5-11(16)17/h3-5H2,1-2H3,(H,14,15)(H,16,17)