9-(3-methylphenyl)-2-(2-methylpropyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 9-(3-methylphenyl)-2-(2-methylpropyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 2-isobutyl-9-(m-tolyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 9-(3-methylphenyl)-2-(2-methylpropyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 9-(3-methylphenyl)-2-(2-methylpropyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 2-isobutyl-8-keto-9-(m-tolyl)-7H-purine-6-carboxamide Formula: C17H19N5O2 MolecularWeight: 325.36506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N5O2/c1-9(2)7-12-19-13(15(18)23)14-16(20-12)22(17(24)21-14)11-6-4-5-10(3)8-11/h4-6,8-9H,7H2,1-3H3,(H2,18,23)(H,21,24)