8-[5-(1H-benzimidazol-2-yl)pentyl]-1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name: 8-[5-(1H-benzimidazol-2-yl)pentyl]-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-[5-(1H-benzimidazol-2-yl)pentyl]-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-[5-(1H-benzimidazol-2-yl)pentyl]-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-[5-(1H-benzimidazol-2-yl)pentyl]-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-[5-(1H-benzimidazol-2-yl)pentyl]-1,3-dimethyl-7H-purine-2,6-quinone Formula: C19H22N6O2 MolecularWeight: 366.41698

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)CCCCCC3=NC4=CC=CC=C4N3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)CCCCCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C19H22N6O2/c1-24-17-16(18(26)25(2)19(24)27)22-15(23-17)11-5-3-4-10-14-20-12-8-6-7-9-13(12)21-14/h6-9H,3-5,10-11H2,1-2H3,(H,20,21)(H,22,23)