5-(4-bromophenyl)-1,3-dimethyl-6-(5-methyl-2-oxidanyl-phenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione

Systemtic Name: 5-(4-bromophenyl)-1,3-dimethyl-6-(5-methyl-2-oxidanyl-phenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione Openeye Name: 5-(4-bromophenyl)-6-(2-hydroxy-5-methyl-phenyl)-1,3-dimethyl-pyrrolo[3,4-d]pyrimidine-2,4-dione CAS Name: 5-(4-bromophenyl)-6-(2-hydroxy-5-methylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione IUPAC Name: 5-(4-bromophenyl)-6-(2-hydroxy-5-methylphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione Traditional Name: 5-(4-bromophenyl)-6-(2-hydroxy-5-methyl-phenyl)-1,3-dimethyl-pyrrolo[3,4-d]pyrimidine-2,4-quinone Formula: C21H18BrN3O3 MolecularWeight: 440.28992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)N2C=C3C(=C2C4=CC=C(C=C4)Br)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC1=CC(=C(C=C1)O)N2C=C3C(=C2C4=CC=C(C=C4)Br)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C21H18BrN3O3/c1-12-4-9-17(26)15(10-12)25-11-16-18(20(27)24(3)21(28)23(16)2)19(25)13-5-7-14(22)8-6-13/h4-11,26H,1-3H3