methyl 2,6-bis(azanyl)-5-cyano-4-pyridin-4-yl-4H-thiopyran-3-carboxylate

Systemtic Name: methyl 2,6-bis(azanyl)-5-cyano-4-pyridin-4-yl-4H-thiopyran-3-carboxylate Openeye Name: methyl 2,6-diamino-5-cyano-4-(4-pyridyl)-4H-thiopyran-3-carboxylate CAS Name: 2,6-diamino-5-cyano-4-pyridin-4-yl-4H-thiopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 2,6-diamino-5-cyano-4-pyridin-4-yl-4H-thiopyran-3-carboxylate Traditional Name: 2,6-diamino-5-cyano-4-(4-pyridyl)-4H-thiopyran-3-carboxylic acid methyl ester Formula: C13H12N4O2S MolecularWeight: 288.32498

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C(C1C2=CC=NC=C2)C#N)N)N

Isomeric SMILES

COC(=O)C1=C(SC(=C(C1C2=CC=NC=C2)C#N)N)N

InChI

InChI=1S/C13H12N4O2S/c1-19-13(18)10-9(7-2-4-17-5-3-7)8(6-14)11(15)20-12(10)16/h2-5,9H,15-16H2,1H3