8-cyclopentyl-3-phenyl-6-propyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one

Systemtic Name: 8-cyclopentyl-3-phenyl-6-propyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one Openeye Name: 8-cyclopentyl-3-phenyl-6-propyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one CAS Name: 8-cyclopentyl-3-phenyl-6-propyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one IUPAC Name: 8-cyclopentyl-3-phenyl-6-propyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one Traditional Name: 8-cyclopentyl-3-phenyl-6-propyl-1H-[1,2,4]triazolo[3,4-f]purin-5-one Formula: C20H22N6O MolecularWeight: 362.42828

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=NC(=NC2=C3NN=C(N3C1=O)C4=CC=CC=C4)C5CCCC5

Isomeric SMILES

CCCN1C2=NC(=NC2=C3NN=C(N3C1=O)C4=CC=CC=C4)C5CCCC5

InChI

InChI=1S/C20H22N6O/c1-2-12-25-18-15(21-16(22-18)13-8-6-7-9-13)19-24-23-17(26(19)20(25)27)14-10-4-3-5-11-14/h3-5,10-11,13,24H,2,6-9,12H2,1H3