N6-cycloheptyl-N4,1-diphenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine

Systemtic Name: N6-cycloheptyl-N4,1-diphenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N6-cycloheptyl-N4,1-diphenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N6-cycloheptyl-N4,1-diphenylpyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 6-N-cycloheptyl-4-N,1-diphenylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: (4-anilino-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl)-cycloheptyl-amine Formula: C24H26N6 MolecularWeight: 398.50344

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC2=NC3=C(C=NN3C4=CC=CC=C4)C(=N2)NC5=CC=CC=C5

Isomeric SMILES

C1CCCC(CC1)NC2=NC3=C(C=NN3C4=CC=CC=C4)C(=N2)NC5=CC=CC=C5

InChI

InChI=1S/C24H26N6/c1-2-6-14-19(13-5-1)27-24-28-22(26-18-11-7-3-8-12-18)21-17-25-30(23(21)29-24)20-15-9-4-10-16-20/h3-4,7-12,15-17,19H,1-2,5-6,13-14H2,(H2,26,27,28,29)