9-(3,4-dimethylphenyl)-8-oxidanylidene-2-pyridin-4-yl-7H-purine-6-carboxamide

Systemtic Name: 9-(3,4-dimethylphenyl)-8-oxidanylidene-2-pyridin-4-yl-7H-purine-6-carboxamide Openeye Name: 9-(3,4-dimethylphenyl)-8-oxo-2-(4-pyridyl)-7H-purine-6-carboxamide CAS Name: 9-(3,4-dimethylphenyl)-8-oxo-2-pyridin-4-yl-7H-purine-6-carboxamide IUPAC Name: 9-(3,4-dimethylphenyl)-8-oxo-2-pyridin-4-yl-7H-purine-6-carboxamide Traditional Name: 9-(3,4-dimethylphenyl)-8-keto-2-(4-pyridyl)-7H-purine-6-carboxamide Formula: C19H16N6O2 MolecularWeight: 360.36934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16N6O2/c1-10-3-4-13(9-11(10)2)25-18-15(23-19(25)27)14(16(20)26)22-17(24-18)12-5-7-21-8-6-12/h3-9H,1-2H3,(H2,20,26)(H,23,27)