N'-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)-N-pyridin-1-ium-2-yl-ethane-1,2-diamine

Systemtic Name: N'-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)-N-pyridin-1-ium-2-yl-ethane-1,2-diamine Openeye Name: N'-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)-N-pyridin-1-ium-2-yl-ethane-1,2-diamine CAS Name: N'-(2-methyl-5-pyrazolo[1,5-a]quinazolinyl)-N-(2-pyridin-1-iumyl)ethane-1,2-diamine IUPAC Name: N'-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)-N-pyridin-1-ium-2-ylethane-1,2-diamine Traditional Name: (2-methylpyrazolo[1,5-a]quinazolin-5-yl)-[2-(pyridin-1-ium-2-ylamino)ethyl]amine Formula: C18H19N6+ MolecularWeight: 319.38366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C3=CC=CC=C3C(=NC2=C1)NCCNC4=CC=CC=[NH+]4

Isomeric SMILES

CC1=NN2C3=CC=CC=C3C(=NC2=C1)NCCNC4=CC=CC=[NH+]4

InChI

InChI=1S/C18H18N6/c1-13-12-17-22-18(14-6-2-3-7-15(14)24(17)23-13)21-11-10-20-16-8-4-5-9-19-16/h2-9,12H,10-11H2,1H3,(H,19,20)(H,21,22)/p+1