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

Systemtic Name: 5-[(3-cyano-5-ethoxycarbonyl-4-methyl-thiophen-2-yl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[(3-cyano-5-ethoxycarbonyl-4-methyl-2-thienyl)amino]-5-oxo-pentanoic acid CAS Name: 5-[(3-cyano-5-ethoxycarbonyl-4-methyl-2-thiophenyl)amino]-5-oxopentanoic acid IUPAC Name: 5-[(3-cyano-5-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-5-oxopentanoic acid Traditional Name: 5-[(5-carbethoxy-3-cyano-4-methyl-2-thienyl)amino]-5-keto-valeric acid Formula: C14H16N2O5S MolecularWeight: 324.35224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)CCCC(=O)O)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)CCCC(=O)O)C#N)C

InChI

InChI=1S/C14H16N2O5S/c1-3-21-14(20)12-8(2)9(7-15)13(22-12)16-10(17)5-4-6-11(18)19/h3-6H2,1-2H3,(H,16,17)(H,18,19)