2-(4-methylpiperazin-1-yl)-4-(4-nitrophenyl)-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carbaldehyde

Systemtic Name: 2-(4-methylpiperazin-1-yl)-4-(4-nitrophenyl)-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carbaldehyde Openeye Name: 2-(4-methylpiperazin-1-yl)-4-(4-nitrophenyl)-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carbaldehyde CAS Name: 2-(4-methyl-1-piperazinyl)-4-(4-nitrophenyl)-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxaldehyde IUPAC Name: 2-(4-methylpiperazin-1-yl)-4-(4-nitrophenyl)-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carbaldehyde Traditional Name: 2-(4-methylpiperazino)-4-(4-nitrophenyl)-3,4-dihydropyrimido[1,2-a]benzimidazole-3-carbaldehyde Formula: C22H22N6O3 MolecularWeight: 418.44848

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=NC4=CC=CC=C4N3C(C2C=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=NC3=NC4=CC=CC=C4N3C(C2C=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H22N6O3/c1-25-10-12-26(13-11-25)21-17(14-29)20(15-6-8-16(9-7-15)28(30)31)27-19-5-3-2-4-18(19)23-22(27)24-21/h2-9,14,17,20H,10-13H2,1H3