N6-(3-ethoxypropyl)-N4-(3-methylphenyl)-1-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine

Systemtic Name: N6-(3-ethoxypropyl)-N4-(3-methylphenyl)-1-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N6-(3-ethoxypropyl)-N4-(m-tolyl)-1-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N6-(3-ethoxypropyl)-N4-(3-methylphenyl)-1-phenylpyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 6-N-(3-ethoxypropyl)-4-N-(3-methylphenyl)-1-phenylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: 3-ethoxypropyl-[4-(m-toluidino)-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl]amine Formula: C23H26N6O MolecularWeight: 402.49214

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)NC4=CC=CC(=C4)C

Isomeric SMILES

CCOCCCNC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)NC4=CC=CC(=C4)C

InChI

InChI=1S/C23H26N6O/c1-3-30-14-8-13-24-23-27-21(26-18-10-7-9-17(2)15-18)20-16-25-29(22(20)28-23)19-11-5-4-6-12-19/h4-7,9-12,15-16H,3,8,13-14H2,1-2H3,(H2,24,26,27,28)