6-(3-azanylpropyl)-4-methyl-7-phenyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-(3-azanylpropyl)-4-methyl-7-phenyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(3-aminopropyl)-4-methyl-7-phenyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(3-aminopropyl)-4-methyl-7-phenylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(3-aminopropyl)-4-methyl-7-phenylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(3-aminopropyl)-4-methyl-7-phenyl-purin[7,8-a]imidazole-1,3-quinone Formula: C17H18N6O2 MolecularWeight: 338.36382

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N3C=C(N(C3=N2)CCCN)C4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N3C=C(N(C3=N2)CCCN)C4=CC=CC=C4

InChI

InChI=1S/C17H18N6O2/c1-21-14-13(15(24)20-17(21)25)23-10-12(11-6-3-2-4-7-11)22(9-5-8-18)16(23)19-14/h2-4,6-7,10H,5,8-9,18H2,1H3,(H,20,24,25)