2-[(4-bromophenyl)methyl]-4-methyl-7-phenyl-purino[8,7-b][1,3]oxazole-1,3-dione

Systemtic Name: 2-[(4-bromophenyl)methyl]-4-methyl-7-phenyl-purino[8,7-b][1,3]oxazole-1,3-dione Openeye Name: 2-[(4-bromophenyl)methyl]-4-methyl-7-phenyl-purino[8,7-b]oxazole-1,3-dione CAS Name: 2-[(4-bromophenyl)methyl]-4-methyl-7-phenylpurino[8,7-b]oxazole-1,3-dione IUPAC Name: 2-[(4-bromophenyl)methyl]-4-methyl-7-phenylpurino[8,7-b][1,3]oxazole-1,3-dione Traditional Name: 2-(4-bromobenzyl)-4-methyl-7-phenyl-purino[8,7-b]oxazole-1,3-quinone Formula: C21H15BrN4O3 MolecularWeight: 451.2728

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)CC3=CC=C(C=C3)Br)N4C=C(OC4=N2)C5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)CC3=CC=C(C=C3)Br)N4C=C(OC4=N2)C5=CC=CC=C5

InChI

InChI=1S/C21H15BrN4O3/c1-24-18-17(19(27)26(21(24)28)11-13-7-9-15(22)10-8-13)25-12-16(29-20(25)23-18)14-5-3-2-4-6-14/h2-10,12H,11H2,1H3