2-[[9-methyl-2-(4-methylpiperazin-1-yl)-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]methylidene]propanedinitrile

Systemtic Name: 2-[[9-methyl-2-(4-methylpiperazin-1-yl)-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]methylidene]propanedinitrile Openeye Name: 2-[[9-methyl-2-(4-methylpiperazin-1-yl)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]methylene]propanedinitrile CAS Name: 2-[[9-methyl-2-(4-methyl-1-piperazinyl)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]methylidene]propanedinitrile IUPAC Name: 2-[[9-methyl-2-(4-methylpiperazin-1-yl)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]methylidene]propanedinitrile Traditional Name: 2-[[4-keto-9-methyl-2-(4-methylpiperazino)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]methylene]malononitrile Formula: C18H19N6O+ MolecularWeight: 335.38306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2NC(=C(C(=O)[N+]2=CC=C1)C=C(C#N)C#N)N3CCN(CC3)C

Isomeric SMILES

CC1=C2NC(=C(C(=O)[N+]2=CC=C1)C=C(C#N)C#N)N3CCN(CC3)C

InChI

InChI=1S/C18H18N6O/c1-13-4-3-5-24-16(13)21-17(23-8-6-22(2)7-9-23)15(18(24)25)10-14(11-19)12-20/h3-5,10H,6-9H2,1-2H3/p+1