1-methyl-N6-phenethyl-N4-(phenylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine

Systemtic Name: 1-methyl-N6-phenethyl-N4-(phenylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N4-benzyl-1-methyl-N6-phenethyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: 1-methyl-N6-phenethyl-N4-(phenylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-benzyl-1-methyl-6-N-phenethylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: benzyl-[1-methyl-6-(phenethylamino)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C21H22N6 MolecularWeight: 358.43958

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)NCCC3=CC=CC=C3)NCC4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)NCCC3=CC=CC=C3)NCC4=CC=CC=C4

InChI

InChI=1S/C21H22N6/c1-27-20-18(15-24-27)19(23-14-17-10-6-3-7-11-17)25-21(26-20)22-13-12-16-8-4-2-5-9-16/h2-11,15H,12-14H2,1H3,(H2,22,23,25,26)