N4-[(1R,2S)-2-phenylcyclohexyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine

Systemtic Name: N4-[(1R,2S)-2-phenylcyclohexyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N4-[(1R,2S)-2-phenylcyclohexyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N4-[(1R,2S)-2-phenylcyclohexyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-[(1R,2S)-2-phenylcyclohexyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: (6-amino-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-[(1R,2S)-2-phenylcyclohexyl]amine Formula: C17H20N6 MolecularWeight: 308.3809

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C2=CC=CC=C2)NC3=NC(=NC4=C3C=NN4)N

Isomeric SMILES

C1CC[C@H]([C@@H](C1)C2=CC=CC=C2)NC3=NC(=NC4=C3C=NN4)N

InChI

InChI=1S/C17H20N6/c18-17-21-15(13-10-19-23-16(13)22-17)20-14-9-5-4-8-12(14)11-6-2-1-3-7-11/h1-3,6-7,10,12,14H,4-5,8-9H2,(H4,18,19,20,21,22,23)/t12-,14+/m0/s1