4,7,8-trimethyl-6-(3-phenylazanylpropyl)purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 4,7,8-trimethyl-6-(3-phenylazanylpropyl)purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(3-anilinopropyl)-4,7,8-trimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(3-anilinopropyl)-4,7,8-trimethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(3-anilinopropyl)-4,7,8-trimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(3-anilinopropyl)-4,7,8-trimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C19H22N6O2 MolecularWeight: 366.41698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C3=C(N=C2N1CCCNC4=CC=CC=C4)N(C(=O)NC3=O)C)C

Isomeric SMILES

CC1=C(N2C3=C(N=C2N1CCCNC4=CC=CC=C4)N(C(=O)NC3=O)C)C

InChI

InChI=1S/C19H22N6O2/c1-12-13(2)25-15-16(23(3)19(27)22-17(15)26)21-18(25)24(12)11-7-10-20-14-8-5-4-6-9-14/h4-6,8-9,20H,7,10-11H2,1-3H3,(H,22,26,27)