methyl 5-azanyl-8-cyano-3-oxidanylidene-7-pyridin-4-yl-2-(pyridin-4-ylmethylidene)-7H-[1,3]thiazolo[3,2-a]pyridine-6-carboxylate

Systemtic Name: methyl 5-azanyl-8-cyano-3-oxidanylidene-7-pyridin-4-yl-2-(pyridin-4-ylmethylidene)-7H-[1,3]thiazolo[3,2-a]pyridine-6-carboxylate Openeye Name: methyl 5-amino-8-cyano-3-oxo-7-(4-pyridyl)-2-(4-pyridylmethylene)-7H-thiazolo[3,2-a]pyridine-6-carboxylate CAS Name: 5-amino-8-cyano-3-oxo-7-pyridin-4-yl-2-(pyridin-4-ylmethylidene)-7H-thiazolo[3,2-a]pyridine-6-carboxylic acid methyl ester IUPAC Name: methyl 5-amino-8-cyano-3-oxo-7-pyridin-4-yl-2-(pyridin-4-ylmethylidene)-7H-[1,3]thiazolo[3,2-a]pyridine-6-carboxylate Traditional Name: 5-amino-8-cyano-3-keto-7-(4-pyridyl)-2-(4-pyridylmethylene)-7H-thiazolo[3,2-a]pyridine-6-carboxylic acid methyl ester Formula: C21H15N5O3S MolecularWeight: 417.4405

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N2C(=C(C1C3=CC=NC=C3)C#N)SC(=CC4=CC=NC=C4)C2=O)N

Isomeric SMILES

COC(=O)C1=C(N2C(=C(C1C3=CC=NC=C3)C#N)SC(=CC4=CC=NC=C4)C2=O)N

InChI

InChI=1S/C21H15N5O3S/c1-29-21(28)17-16(13-4-8-25-9-5-13)14(11-22)20-26(18(17)23)19(27)15(30-20)10-12-2-6-24-7-3-12/h2-10,16H,23H2,1H3