(E)-2-cyano-N-methyl-3-[2-(4-methylpiperazin-1-yl)-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-methyl-3-[2-(4-methylpiperazin-1-yl)-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]prop-2-enamide Openeye Name: (E)-2-cyano-N-methyl-3-[2-(4-methylpiperazin-1-yl)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-methyl-3-[2-(4-methyl-1-piperazinyl)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]-2-propenamide IUPAC Name: (E)-2-cyano-N-methyl-3-[2-(4-methylpiperazin-1-yl)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]prop-2-enamide Traditional Name: (E)-2-cyano-3-[4-keto-2-(4-methylpiperazino)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]-N-methyl-acrylamide Formula: C18H21N6O2+ MolecularWeight: 353.39834

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C(=CC1=C(NC2=CC=CC=[N+]2C1=O)N3CCN(CC3)C)C#N

Isomeric SMILES

CNC(=O)/C(=C/C1=C(NC2=CC=CC=[N+]2C1=O)N3CCN(CC3)C)/C#N

InChI

InChI=1S/C18H20N6O2/c1-20-17(25)13(12-19)11-14-16(23-9-7-22(2)8-10-23)21-15-5-3-4-6-24(15)18(14)26/h3-6,11H,7-10H2,1-2H3,(H,20,25)/p+1/b13-11+