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

Systemtic Name: 2-butyl-9-(3,4-dimethylphenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 2-butyl-9-(3,4-dimethylphenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 2-butyl-9-(3,4-dimethylphenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 2-butyl-9-(3,4-dimethylphenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 2-butyl-9-(3,4-dimethylphenyl)-8-keto-7H-purine-6-carboxamide Formula: C18H21N5O2 MolecularWeight: 339.39164

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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(=O)N

Isomeric SMILES

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

InChI

InChI=1S/C18H21N5O2/c1-4-5-6-13-20-14(16(19)24)15-17(21-13)23(18(25)22-15)12-8-7-10(2)11(3)9-12/h7-9H,4-6H2,1-3H3,(H2,19,24)(H,22,25)