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

Systemtic Name: (E)-2-cyano-N-cyclohexyl-3-[9-methyl-2-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide Openeye Name: (E)-2-cyano-N-cyclohexyl-3-[9-methyl-2-(4-methylpiperazin-4-ium-1-yl)-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-cyclohexyl-3-[9-methyl-2-(4-methyl-1-piperazin-4-iumyl)-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-cyclohexyl-3-[9-methyl-2-(4-methylpiperazin-4-ium-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide Traditional Name: (E)-2-cyano-N-cyclohexyl-3-[4-keto-9-methyl-2-(4-methylpiperazin-4-ium-1-yl)pyrido[1,2-a]pyrimidin-3-yl]acrylamide Formula: C24H31N6O2+ MolecularWeight: 435.54194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)C(=O)NC3CCCCC3)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC=CN2C1=NC(=C(C2=O)/C=C(\C#N)/C(=O)NC3CCCCC3)N4CC[NH+](CC4)C

InChI

InChI=1S/C24H30N6O2/c1-17-7-6-10-30-21(17)27-22(29-13-11-28(2)12-14-29)20(24(30)32)15-18(16-25)23(31)26-19-8-4-3-5-9-19/h6-7,10,15,19H,3-5,8-9,11-14H2,1-2H3,(H,26,31)/p+1/b18-15+