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

Systemtic Name: (E)-2-cyano-3-[2-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]-N-prop-2-enyl-prop-2-enamide Openeye Name: (E)-N-allyl-2-cyano-3-[2-(4-methylpiperazin-4-ium-1-yl)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]prop-2-enamide CAS Name: (E)-2-cyano-3-[2-(4-methyl-1-piperazin-4-iumyl)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]-N-prop-2-enyl-2-propenamide IUPAC Name: (E)-2-cyano-3-[2-(4-methylpiperazin-4-ium-1-yl)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]-N-prop-2-enylprop-2-enamide Traditional Name: (E)-N-allyl-2-cyano-3-[4-keto-2-(4-methylpiperazin-4-ium-1-yl)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]acrylamide Formula: C20H24N6O2+2 MolecularWeight: 380.44356

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C(=O)[N+]3=CC=CC=C3N2)C=C(C#N)C(=O)NCC=C

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C(=O)[N+]3=CC=CC=C3N2)/C=C(\C#N)/C(=O)NCC=C

InChI

InChI=1S/C20H22N6O2/c1-3-7-22-19(27)15(14-21)13-16-18(25-11-9-24(2)10-12-25)23-17-6-4-5-8-26(17)20(16)28/h3-6,8,13H,1,7,9-12H2,2H3,(H,22,27)/p+2/b15-13+