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

Systemtic Name: 5-[(3-cyano-4,5-dimethyl-thiophen-2-yl)amino]-5-oxidanylidene-pentanoate Openeye Name: 5-[(3-cyano-4,5-dimethyl-2-thienyl)amino]-5-oxo-pentanoate CAS Name: 5-[(3-cyano-4,5-dimethyl-2-thiophenyl)amino]-5-oxopentanoate IUPAC Name: 5-[(3-cyano-4,5-dimethylthiophen-2-yl)amino]-5-oxopentanoate Traditional Name: 5-[(3-cyano-4,5-dimethyl-2-thienyl)amino]-5-keto-valerate Formula: C12H13N2O3S- MolecularWeight: 265.30822

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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