N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-pyridin-3-yl-quinazolin-4-amine

Systemtic Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-pyridin-3-yl-quinazolin-4-amine Openeye Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-(3-pyridyl)quinazolin-4-amine CAS Name: N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-(3-pyridinyl)-4-quinazolinamine IUPAC Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-pyridin-3-ylquinazolin-4-amine Traditional Name: [4-(4-methylpiperazin-4-ium-1-yl)phenyl]-[2-(3-pyridyl)quinazolin-4-yl]amine Formula: C24H25N6+ MolecularWeight: 397.4955

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NC3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NC3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5

InChI

InChI=1S/C24H24N6/c1-29-13-15-30(16-14-29)20-10-8-19(9-11-20)26-24-21-6-2-3-7-22(21)27-23(28-24)18-5-4-12-25-17-18/h2-12,17H,13-16H2,1H3,(H,26,27,28)/p+1