ethyl 5-cyano-2-methyl-4-phenyl-5-prop-2-enyl-6-sulfanylidene-1,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-2-methyl-4-phenyl-5-prop-2-enyl-6-sulfanylidene-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 5-allyl-5-cyano-2-methyl-4-phenyl-6-thioxo-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-4-phenyl-5-prop-2-enyl-6-sulfanylidene-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-methyl-4-phenyl-5-prop-2-enyl-6-sulfanylidene-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-allyl-5-cyano-2-methyl-4-phenyl-6-thioxo-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C19H20N2O2S MolecularWeight: 340.4393

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O2S/c1-4-11-19(12-20)16(14-9-7-6-8-10-14)15(17(22)23-5-2)13(3)21-18(19)24/h4,6-10,16H,1,5,11H2,2-3H3,(H,21,24)