2-butyl-9-(4-tert-butylphenyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 2-butyl-9-(4-tert-butylphenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 2-butyl-9-(4-tert-butylphenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 2-butyl-9-(4-tert-butylphenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 2-butyl-9-(4-tert-butylphenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 2-butyl-9-(4-tert-butylphenyl)-8-keto-7H-purine-6-carboxamide Formula: C20H25N5O2 MolecularWeight: 367.4448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C2C(=N1)N(C(=O)N2)C3=CC=C(C=C3)C(C)(C)C)C(=O)N

Isomeric SMILES

CCCCC1=NC(=C2C(=N1)N(C(=O)N2)C3=CC=C(C=C3)C(C)(C)C)C(=O)N

InChI

InChI=1S/C20H25N5O2/c1-5-6-7-14-22-15(17(21)26)16-18(23-14)25(19(27)24-16)13-10-8-12(9-11-13)20(2,3)4/h8-11H,5-7H2,1-4H3,(H2,21,26)(H,24,27)