ethyl 3-cyano-6-methyl-4-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyridine-5-carboxylate

Systemtic Name: ethyl 3-cyano-6-methyl-4-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyridine-5-carboxylate Openeye Name: ethyl 3-cyano-6-methyl-4-phenyl-2-thioxo-3,4-dihydro-1H-pyridine-5-carboxylate CAS Name: 3-cyano-6-methyl-4-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-6-methyl-4-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyridine-5-carboxylate Traditional Name: 3-cyano-6-methyl-4-phenyl-2-thioxo-3,4-dihydro-1H-pyridine-5-carboxylic acid ethyl ester Formula: C16H16N2O2S MolecularWeight: 300.37544

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=S)C(C1C2=CC=CC=C2)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=S)C(C1C2=CC=CC=C2)C#N)C

InChI

InChI=1S/C16H16N2O2S/c1-3-20-16(19)13-10(2)18-15(21)12(9-17)14(13)11-7-5-4-6-8-11/h4-8,12,14H,3H2,1-2H3,(H,18,21)