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

Systemtic Name: 1-methyl-N6-(3-methylbutyl)-N4-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N6-isopentyl-1-methyl-N4-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: 1-methyl-N6-(3-methylbutyl)-N4-phenylpyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 1-methyl-6-N-(3-methylbutyl)-4-N-phenylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: (4-anilino-1-methyl-pyrazolo[3,4-d]pyrimidin-6-yl)-isoamyl-amine Formula: C17H22N6 MolecularWeight: 310.39678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC2=C(C=NN2C)C(=N1)NC3=CC=CC=C3

Isomeric SMILES

CC(C)CCNC1=NC2=C(C=NN2C)C(=N1)NC3=CC=CC=C3

InChI

InChI=1S/C17H22N6/c1-12(2)9-10-18-17-21-15(20-13-7-5-4-6-8-13)14-11-19-23(3)16(14)22-17/h4-8,11-12H,9-10H2,1-3H3,(H2,18,20,21,22)