2-butyl-6-(3-chloranyl-4-methoxy-phenyl)-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione

Systemtic Name: 2-butyl-6-(3-chloranyl-4-methoxy-phenyl)-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Openeye Name: 2-butyl-6-(3-chloro-4-methoxy-phenyl)-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione CAS Name: 2-butyl-6-(3-chloro-4-methoxyphenyl)-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione IUPAC Name: 2-butyl-6-(3-chloro-4-methoxyphenyl)-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-butyl-6-(3-chloro-4-methoxy-phenyl)-4-methyl-7,8-dihydropurin[7,8-a]imidazole-1,3-quinone Formula: C19H22ClN5O3 MolecularWeight: 403.86268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(N=C3N2CCN3C4=CC(=C(C=C4)OC)Cl)N(C1=O)C

Isomeric SMILES

CCCCN1C(=O)C2=C(N=C3N2CCN3C4=CC(=C(C=C4)OC)Cl)N(C1=O)C

InChI

InChI=1S/C19H22ClN5O3/c1-4-5-8-25-17(26)15-16(22(2)19(25)27)21-18-23(9-10-24(15)18)12-6-7-14(28-3)13(20)11-12/h6-7,11H,4-5,8-10H2,1-3H3