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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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