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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC(=CC=C3)Br)C4=CC=C(C=C4)OC

Isomeric SMILES

CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC(=CC=C3)Br)C4=CC=C(C=C4)OC

InChI

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