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

Systemtic Name: 5-(4-bromophenyl)-6-(2-ethoxyphenyl)-1,3-dimethyl-pyrrolo[3,4-d]pyrimidine-2,4-dione Openeye Name: 5-(4-bromophenyl)-6-(2-ethoxyphenyl)-1,3-dimethyl-pyrrolo[3,4-d]pyrimidine-2,4-dione CAS Name: 5-(4-bromophenyl)-6-(2-ethoxyphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione IUPAC Name: 5-(4-bromophenyl)-6-(2-ethoxyphenyl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione Traditional Name: 5-(4-bromophenyl)-1,3-dimethyl-6-o-phenetyl-pyrrolo[3,4-d]pyrimidine-2,4-quinone Formula: C22H20BrN3O3 MolecularWeight: 454.3165

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C=C3C(=C2C4=CC=C(C=C4)Br)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CCOC1=CC=CC=C1N2C=C3C(=C2C4=CC=C(C=C4)Br)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C22H20BrN3O3/c1-4-29-18-8-6-5-7-16(18)26-13-17-19(21(27)25(3)22(28)24(17)2)20(26)14-9-11-15(23)12-10-14/h5-13H,4H2,1-3H3