methyl 1-[(5-chloranylthiophen-2-yl)methyl]-5-cyano-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: methyl 1-[(5-chloranylthiophen-2-yl)methyl]-5-cyano-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: methyl 1-[(5-chloro-2-thienyl)methyl]-5-cyano-6-oxo-pyridine-3-carboxylate CAS Name: 1-[(5-chloro-2-thiophenyl)methyl]-5-cyano-6-oxo-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(5-chlorothiophen-2-yl)methyl]-5-cyano-6-oxopyridine-3-carboxylate Traditional Name: 1-[(5-chloro-2-thienyl)methyl]-5-cyano-6-keto-nicotinic acid methyl ester Formula: C13H9ClN2O3S MolecularWeight: 308.74016

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C(=O)C(=C1)C#N)CC2=CC=C(S2)Cl

Isomeric SMILES

COC(=O)C1=CN(C(=O)C(=C1)C#N)CC2=CC=C(S2)Cl

InChI

InChI=1S/C13H9ClN2O3S/c1-19-13(18)9-4-8(5-15)12(17)16(6-9)7-10-2-3-11(14)20-10/h2-4,6H,7H2,1H3