2-(6-bromanylpyridin-2-yl)-9-(4-methylphenyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 2-(6-bromanylpyridin-2-yl)-9-(4-methylphenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 2-(6-bromo-2-pyridyl)-8-oxo-9-(p-tolyl)-7H-purine-6-carboxamide CAS Name: 2-(6-bromo-2-pyridinyl)-9-(4-methylphenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 2-(6-bromopyridin-2-yl)-9-(4-methylphenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 2-(6-bromo-2-pyridyl)-8-keto-9-(p-tolyl)-7H-purine-6-carboxamide Formula: C18H13BrN6O2 MolecularWeight: 425.23882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=NC(=CC=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=NC(=CC=C4)Br

InChI

InChI=1S/C18H13BrN6O2/c1-9-5-7-10(8-6-9)25-17-14(23-18(25)27)13(15(20)26)22-16(24-17)11-3-2-4-12(19)21-11/h2-8H,1H3,(H2,20,26)(H,23,27)