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

Systemtic Name: ethyl 3-cyano-6-methyl-4-(2-methylpropyl)-2-sulfanylidene-3,4-dihydro-1H-pyridine-5-carboxylate Openeye Name: ethyl 3-cyano-4-isobutyl-6-methyl-2-thioxo-3,4-dihydro-1H-pyridine-5-carboxylate CAS Name: 3-cyano-6-methyl-4-(2-methylpropyl)-2-sulfanylidene-3,4-dihydro-1H-pyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-6-methyl-4-(2-methylpropyl)-2-sulfanylidene-3,4-dihydro-1H-pyridine-5-carboxylate Traditional Name: 3-cyano-4-isobutyl-6-methyl-2-thioxo-3,4-dihydro-1H-pyridine-5-carboxylic acid ethyl ester Formula: C14H20N2O2S MolecularWeight: 280.3858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=S)C(C1CC(C)C)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=S)C(C1CC(C)C)C#N)C

InChI

InChI=1S/C14H20N2O2S/c1-5-18-14(17)12-9(4)16-13(19)11(7-15)10(12)6-8(2)3/h8,10-11H,5-6H2,1-4H3,(H,16,19)