N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-[[4-(4-morpholin-4-iumylmethyl)phenyl]methyl]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-1-phenylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [4-(morpholin-4-ium-4-ylmethyl)benzyl]-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C23H25N6O+ MolecularWeight: 401.4842

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=C(C=C2)CNC3=NC=NC4=C3C=NN4C5=CC=CC=C5

Isomeric SMILES

C1COCC[NH+]1CC2=CC=C(C=C2)CNC3=NC=NC4=C3C=NN4C5=CC=CC=C5

InChI

InChI=1S/C23H24N6O/c1-2-4-20(5-3-1)29-23-21(15-27-29)22(25-17-26-23)24-14-18-6-8-19(9-7-18)16-28-10-12-30-13-11-28/h1-9,15,17H,10-14,16H2,(H,24,25,26)/p+1