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

Systemtic Name: 9-(3,4-dimethylphenyl)-8-oxidanylidene-2-pentan-3-yl-7H-purine-6-carboxamide Openeye Name: 9-(3,4-dimethylphenyl)-2-(1-ethylpropyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 9-(3,4-dimethylphenyl)-8-oxo-2-pentan-3-yl-7H-purine-6-carboxamide IUPAC Name: 9-(3,4-dimethylphenyl)-8-oxo-2-pentan-3-yl-7H-purine-6-carboxamide Traditional Name: 9-(3,4-dimethylphenyl)-2-(1-ethylpropyl)-8-keto-7H-purine-6-carboxamide Formula: C19H23N5O2 MolecularWeight: 353.41822

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NC(=C2C(=N1)N(C(=O)N2)C3=CC(=C(C=C3)C)C)C(=O)N

Isomeric SMILES

CCC(CC)C1=NC(=C2C(=N1)N(C(=O)N2)C3=CC(=C(C=C3)C)C)C(=O)N

InChI

InChI=1S/C19H23N5O2/c1-5-12(6-2)17-21-14(16(20)25)15-18(23-17)24(19(26)22-15)13-8-7-10(3)11(4)9-13/h7-9,12H,5-6H2,1-4H3,(H2,20,25)(H,22,26)