N-(6-azanyl-9-pentyl-8-pyrazol-1-yl-purin-2-yl)-2,2-dimethyl-propanamide

Systemtic Name: N-(6-azanyl-9-pentyl-8-pyrazol-1-yl-purin-2-yl)-2,2-dimethyl-propanamide Openeye Name: N-(6-amino-9-pentyl-8-pyrazol-1-yl-purin-2-yl)-2,2-dimethyl-propanamide CAS Name: N-[6-amino-9-pentyl-8-(1-pyrazolyl)-2-purinyl]-2,2-dimethylpropanamide IUPAC Name: N-(6-amino-9-pentyl-8-pyrazol-1-ylpurin-2-yl)-2,2-dimethylpropanamide Traditional Name: N-(6-amino-9-amyl-8-pyrazol-1-yl-purin-2-yl)-2,2-dimethyl-propionamide Formula: C18H26N8O MolecularWeight: 370.45204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=C(C(=NC(=N2)NC(=O)C(C)(C)C)N)N=C1N3C=CC=N3

Isomeric SMILES

CCCCCN1C2=C(C(=NC(=N2)NC(=O)C(C)(C)C)N)N=C1N3C=CC=N3

InChI

InChI=1S/C18H26N8O/c1-5-6-7-10-25-14-12(21-17(25)26-11-8-9-20-26)13(19)22-16(23-14)24-15(27)18(2,3)4/h8-9,11H,5-7,10H2,1-4H3,(H3,19,22,23,24,27)