N-(2,3-dihydro-1H-inden-2-yl)-2-(3,5-dimethylpyrazol-1-yl)-9-methyl-purin-6-amine

Systemtic Name: N-(2,3-dihydro-1H-inden-2-yl)-2-(3,5-dimethylpyrazol-1-yl)-9-methyl-purin-6-amine Openeye Name: 2-(3,5-dimethylpyrazol-1-yl)-N-indan-2-yl-9-methyl-purin-6-amine CAS Name: N-(2,3-dihydro-1H-inden-2-yl)-2-(3,5-dimethyl-1-pyrazolyl)-9-methyl-6-purinamine IUPAC Name: N-(2,3-dihydro-1H-inden-2-yl)-2-(3,5-dimethylpyrazol-1-yl)-9-methylpurin-6-amine Traditional Name: [2-(3,5-dimethylpyrazol-1-yl)-9-methyl-purin-6-yl]-indan-2-yl-amine Formula: C20H21N7 MolecularWeight: 359.42764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC3=C(C(=N2)NC4CC5=CC=CC=C5C4)N=CN3C)C

Isomeric SMILES

CC1=CC(=NN1C2=NC3=C(C(=N2)NC4CC5=CC=CC=C5C4)N=CN3C)C

InChI

InChI=1S/C20H21N7/c1-12-8-13(2)27(25-12)20-23-18(17-19(24-20)26(3)11-21-17)22-16-9-14-6-4-5-7-15(14)10-16/h4-8,11,16H,9-10H2,1-3H3,(H,22,23,24)