2-pyridin-3-yl-4-[4-(pyridin-3-ylmethyl)piperazin-4-ium-1-yl]quinazoline

Systemtic Name: 2-pyridin-3-yl-4-[4-(pyridin-3-ylmethyl)piperazin-4-ium-1-yl]quinazoline Openeye Name: 2-(3-pyridyl)-4-[4-(3-pyridylmethyl)piperazin-4-ium-1-yl]quinazoline CAS Name: 2-(3-pyridinyl)-4-[4-(3-pyridinylmethyl)-1-piperazin-4-iumyl]quinazoline IUPAC Name: 2-pyridin-3-yl-4-[4-(pyridin-3-ylmethyl)piperazin-4-ium-1-yl]quinazoline Traditional Name: 2-(3-pyridyl)-4-[4-(3-pyridylmethyl)piperazin-4-ium-1-yl]quinazoline Formula: C23H23N6+ MolecularWeight: 383.46892

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CN=CC=C2)C3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1CC2=CN=CC=C2)C3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5

InChI

InChI=1S/C23H22N6/c1-2-8-21-20(7-1)23(27-22(26-21)19-6-4-10-25-16-19)29-13-11-28(12-14-29)17-18-5-3-9-24-15-18/h1-10,15-16H,11-14,17H2/p+1