1-(4-methylphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1-(4-methylphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-(4-methylphenyl)-N-[3-(4-morpholin-4-iumyl)propyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-(4-methylphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: 3-morpholin-4-ium-4-ylpropyl-[1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C19H25N6O+ MolecularWeight: 353.4414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NCCC[NH+]4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NCCC[NH+]4CCOCC4

InChI

InChI=1S/C19H24N6O/c1-15-3-5-16(6-4-15)25-19-17(13-23-25)18(21-14-22-19)20-7-2-8-24-9-11-26-12-10-24/h3-6,13-14H,2,7-12H2,1H3,(H,20,21,22)/p+1