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

Systemtic Name: 6-(1-adamantyl)-1,3-dimethyl-5-phenyl-pyrrolo[3,4-d]pyrimidine-2,4-dione Openeye Name: 6-(1-adamantyl)-1,3-dimethyl-5-phenyl-pyrrolo[3,4-d]pyrimidine-2,4-dione CAS Name: 6-(1-adamantyl)-1,3-dimethyl-5-phenylpyrrolo[3,4-d]pyrimidine-2,4-dione IUPAC Name: 6-(1-adamantyl)-1,3-dimethyl-5-phenylpyrrolo[3,4-d]pyrimidine-2,4-dione Traditional Name: 6-(1-adamantyl)-1,3-dimethyl-5-phenyl-pyrrolo[3,4-d]pyrimidine-2,4-quinone Formula: C24H27N3O2 MolecularWeight: 389.49008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC=CC=C3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC=CC=C3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C24H27N3O2/c1-25-19-14-27(24-11-15-8-16(12-24)10-17(9-15)13-24)21(18-6-4-3-5-7-18)20(19)22(28)26(2)23(25)29/h3-7,14-17H,8-13H2,1-2H3