6-(1H-indol-4-yl)-N-(3-methoxyphenyl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 6-(1H-indol-4-yl)-N-(3-methoxyphenyl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 6-(1H-indol-4-yl)-N-(3-methoxyphenyl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 6-(1H-indol-4-yl)-N-(3-methoxyphenyl)-1-methyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 6-(1H-indol-4-yl)-N-(3-methoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [6-(1H-indol-4-yl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]-(3-methoxyphenyl)amine Formula: C21H18N6O MolecularWeight: 370.40722

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)C3=C4C=CNC4=CC=C3)NC5=CC(=CC=C5)OC

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)C3=C4C=CNC4=CC=C3)NC5=CC(=CC=C5)OC

InChI

InChI=1S/C21H18N6O/c1-27-21-17(12-23-27)20(24-13-5-3-6-14(11-13)28-2)25-19(26-21)16-7-4-8-18-15(16)9-10-22-18/h3-12,22H,1-2H3,(H,24,25,26)