(Z)-2-cyano-3-[9-methyl-2-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide

Systemtic Name: (Z)-2-cyano-3-[9-methyl-2-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide Openeye Name: (Z)-2-cyano-3-[9-methyl-2-(4-methylpiperazin-4-ium-1-yl)-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide CAS Name: (Z)-2-cyano-3-[9-methyl-2-(4-methyl-1-piperazin-4-iumyl)-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-propenamide IUPAC Name: (Z)-2-cyano-3-[9-methyl-2-(4-methylpiperazin-4-ium-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide Traditional Name: (Z)-2-cyano-3-[4-keto-9-methyl-2-(4-methylpiperazin-4-ium-1-yl)pyrido[1,2-a]pyrimidin-3-yl]acrylamide Formula: C18H21N6O2+ MolecularWeight: 353.39834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)C(=O)N)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=CN2C1=NC(=C(C2=O)/C=C(/C#N)\C(=O)N)N3CC[NH+](CC3)C

InChI

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