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

Systemtic Name: 5-(2-bromophenyl)-6-cycloheptyl-1,3-dimethyl-pyrrolo[3,4-d]pyrimidine-2,4-dione Openeye Name: 5-(2-bromophenyl)-6-cycloheptyl-1,3-dimethyl-pyrrolo[3,4-d]pyrimidine-2,4-dione CAS Name: 5-(2-bromophenyl)-6-cycloheptyl-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione IUPAC Name: 5-(2-bromophenyl)-6-cycloheptyl-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione Traditional Name: 5-(2-bromophenyl)-6-cycloheptyl-1,3-dimethyl-pyrrolo[3,4-d]pyrimidine-2,4-quinone Formula: C21H24BrN3O2 MolecularWeight: 430.33816

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC=CC=C3Br)C4CCCCCC4

Isomeric SMILES

CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC=CC=C3Br)C4CCCCCC4

InChI

InChI=1S/C21H24BrN3O2/c1-23-17-13-25(14-9-5-3-4-6-10-14)19(15-11-7-8-12-16(15)22)18(17)20(26)24(2)21(23)27/h7-8,11-14H,3-6,9-10H2,1-2H3