N-(6-azanyl-9-propyl-8-pyrazol-1-yl-purin-2-yl)-2,2-diphenyl-ethanamide

Systemtic Name: N-(6-azanyl-9-propyl-8-pyrazol-1-yl-purin-2-yl)-2,2-diphenyl-ethanamide Openeye Name: N-(6-amino-9-propyl-8-pyrazol-1-yl-purin-2-yl)-2,2-diphenyl-acetamide CAS Name: N-[6-amino-9-propyl-8-(1-pyrazolyl)-2-purinyl]-2,2-diphenylacetamide IUPAC Name: N-(6-amino-9-propyl-8-pyrazol-1-ylpurin-2-yl)-2,2-diphenylacetamide Traditional Name: N-(6-amino-9-propyl-8-pyrazol-1-yl-purin-2-yl)-2,2-diphenyl-acetamide Formula: C25H24N8O MolecularWeight: 452.51106

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC(=N2)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)N)N=C1N5C=CC=N5

Isomeric SMILES

CCCN1C2=C(C(=NC(=N2)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)N)N=C1N5C=CC=N5

InChI

InChI=1S/C25H24N8O/c1-2-15-32-22-20(28-25(32)33-16-9-14-27-33)21(26)29-24(30-22)31-23(34)19(17-10-5-3-6-11-17)18-12-7-4-8-13-18/h3-14,16,19H,2,15H2,1H3,(H3,26,29,30,31,34)