8-(4-bromophenyl)-1-methyl-5-propyl-purino[8,9-c][1,2,4]triazole-2,4-dione

Systemtic Name: 8-(4-bromophenyl)-1-methyl-5-propyl-purino[8,9-c][1,2,4]triazole-2,4-dione Openeye Name: 8-(4-bromophenyl)-1-methyl-5-propyl-purino[8,9-c][1,2,4]triazole-2,4-dione CAS Name: 8-(4-bromophenyl)-1-methyl-5-propylpurino[8,9-c][1,2,4]triazole-2,4-dione IUPAC Name: 8-(4-bromophenyl)-1-methyl-5-propylpurino[8,9-c][1,2,4]triazole-2,4-dione Traditional Name: 8-(4-bromophenyl)-1-methyl-5-propyl-purino[8,9-c][1,2,4]triazole-2,4-quinone Formula: C16H15BrN6O2 MolecularWeight: 403.2333

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(N(C(=O)NC2=O)C)N3C1=NN=C3C4=CC=C(C=C4)Br

Isomeric SMILES

CCCN1C2=C(N(C(=O)NC2=O)C)N3C1=NN=C3C4=CC=C(C=C4)Br

InChI

InChI=1S/C16H15BrN6O2/c1-3-8-22-11-13(24)18-16(25)21(2)14(11)23-12(19-20-15(22)23)9-4-6-10(17)7-5-9/h4-7H,3,8H2,1-2H3,(H,18,24,25)