5-(3-bromophenyl)-1,3-dimethyl-6-(2-methyl-1-oxidanyl-propan-2-yl)pyrrolo[3,4-d]pyrimidine-2,4-dione

Systemtic Name: 5-(3-bromophenyl)-1,3-dimethyl-6-(2-methyl-1-oxidanyl-propan-2-yl)pyrrolo[3,4-d]pyrimidine-2,4-dione Openeye Name: 5-(3-bromophenyl)-6-(2-hydroxy-1,1-dimethyl-ethyl)-1,3-dimethyl-pyrrolo[3,4-d]pyrimidine-2,4-dione CAS Name: 5-(3-bromophenyl)-6-(1-hydroxy-2-methylpropan-2-yl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione IUPAC Name: 5-(3-bromophenyl)-6-(1-hydroxy-2-methylpropan-2-yl)-1,3-dimethylpyrrolo[3,4-d]pyrimidine-2,4-dione Traditional Name: 5-(3-bromophenyl)-6-(2-hydroxy-1,1-dimethyl-ethyl)-1,3-dimethyl-pyrrolo[3,4-d]pyrimidine-2,4-quinone Formula: C18H20BrN3O3 MolecularWeight: 406.2737

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)N1C=C2C(=C1C3=CC(=CC=C3)Br)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CC(C)(CO)N1C=C2C(=C1C3=CC(=CC=C3)Br)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C18H20BrN3O3/c1-18(2,10-23)22-9-13-14(16(24)21(4)17(25)20(13)3)15(22)11-6-5-7-12(19)8-11/h5-9,23H,10H2,1-4H3