N-(6-azanyl-9-propyl-8-pyrazol-1-yl-purin-2-yl)cyclopentanecarboxamide

Systemtic Name: N-(6-azanyl-9-propyl-8-pyrazol-1-yl-purin-2-yl)cyclopentanecarboxamide Openeye Name: N-(6-amino-9-propyl-8-pyrazol-1-yl-purin-2-yl)cyclopentanecarboxamide CAS Name: N-[6-amino-9-propyl-8-(1-pyrazolyl)-2-purinyl]cyclopentanecarboxamide IUPAC Name: N-(6-amino-9-propyl-8-pyrazol-1-ylpurin-2-yl)cyclopentanecarboxamide Traditional Name: N-(6-amino-9-propyl-8-pyrazol-1-yl-purin-2-yl)cyclopentanecarboxamide Formula: C17H22N8O MolecularWeight: 354.40958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC(=N2)NC(=O)C3CCCC3)N)N=C1N4C=CC=N4

Isomeric SMILES

CCCN1C2=C(C(=NC(=N2)NC(=O)C3CCCC3)N)N=C1N4C=CC=N4

InChI

InChI=1S/C17H22N8O/c1-2-9-24-14-12(20-17(24)25-10-5-8-19-25)13(18)21-16(22-14)23-15(26)11-6-3-4-7-11/h5,8,10-11H,2-4,6-7,9H2,1H3,(H3,18,21,22,23,26)