4-[(3-cyano-4,5-dimethyl-thiophen-2-yl)amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(3-cyano-4,5-dimethyl-thiophen-2-yl)amino]-4-oxidanylidene-butanoate Openeye Name: 4-[(3-cyano-4,5-dimethyl-2-thienyl)amino]-4-oxo-butanoate CAS Name: 4-[(3-cyano-4,5-dimethyl-2-thiophenyl)amino]-4-oxobutanoate IUPAC Name: 4-[(3-cyano-4,5-dimethylthiophen-2-yl)amino]-4-oxobutanoate Traditional Name: 4-[(3-cyano-4,5-dimethyl-2-thienyl)amino]-4-keto-butyrate Formula: C11H11N2O3S- MolecularWeight: 251.28164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)CCC(=O)[O-])C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)CCC(=O)[O-])C

InChI

InChI=1S/C11H12N2O3S/c1-6-7(2)17-11(8(6)5-12)13-9(14)3-4-10(15)16/h3-4H2,1-2H3,(H,13,14)(H,15,16)/p-1