ethyl 7-cyano-3-cyclopentyl-6-sulfanylidene-2,4-dihydro-1H-pyrido[1,2-a][1,3,5]triazine-9-carboxylate

Systemtic Name: ethyl 7-cyano-3-cyclopentyl-6-sulfanylidene-2,4-dihydro-1H-pyrido[1,2-a][1,3,5]triazine-9-carboxylate Openeye Name: ethyl 7-cyano-3-cyclopentyl-6-thioxo-2,4-dihydro-1H-pyrido[1,2-a][1,3,5]triazine-9-carboxylate CAS Name: 7-cyano-3-cyclopentyl-6-sulfanylidene-2,4-dihydro-1H-pyrido[1,2-a][1,3,5]triazine-9-carboxylic acid ethyl ester IUPAC Name: ethyl 7-cyano-3-cyclopentyl-6-sulfanylidene-2,4-dihydro-1H-pyrido[1,2-a][1,3,5]triazine-9-carboxylate Traditional Name: 7-cyano-3-cyclopentyl-6-thioxo-2,4-dihydro-1H-pyrido[1,2-a][1,3,5]triazine-9-carboxylic acid ethyl ester Formula: C16H20N4O2S MolecularWeight: 332.4206

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2NCN(CN2C(=S)C(=C1)C#N)C3CCCC3

Isomeric SMILES

CCOC(=O)C1=C2NCN(CN2C(=S)C(=C1)C#N)C3CCCC3

InChI

InChI=1S/C16H20N4O2S/c1-2-22-16(21)13-7-11(8-17)15(23)20-10-19(9-18-14(13)20)12-5-3-4-6-12/h7,12,18H,2-6,9-10H2,1H3