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

Systemtic Name: 5-(2-bromophenyl)-1,3-dimethyl-6-phenethyl-pyrrolo[3,4-d]pyrimidine-2,4-dione Openeye Name: 5-(2-bromophenyl)-1,3-dimethyl-6-phenethyl-pyrrolo[3,4-d]pyrimidine-2,4-dione CAS Name: 5-(2-bromophenyl)-1,3-dimethyl-6-phenethylpyrrolo[3,4-d]pyrimidine-2,4-dione IUPAC Name: 5-(2-bromophenyl)-1,3-dimethyl-6-phenethylpyrrolo[3,4-d]pyrimidine-2,4-dione Traditional Name: 5-(2-bromophenyl)-1,3-dimethyl-6-phenethyl-pyrrolo[3,4-d]pyrimidine-2,4-quinone Formula: C22H20BrN3O2 MolecularWeight: 438.3171

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC=CC=C3Br)CCC4=CC=CC=C4

Isomeric SMILES

CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC=CC=C3Br)CCC4=CC=CC=C4

InChI

InChI=1S/C22H20BrN3O2/c1-24-18-14-26(13-12-15-8-4-3-5-9-15)20(16-10-6-7-11-17(16)23)19(18)21(27)25(2)22(24)28/h3-11,14H,12-13H2,1-2H3