9-(4-ethoxyphenyl)-2-hexyl-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 9-(4-ethoxyphenyl)-2-hexyl-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 9-(4-ethoxyphenyl)-2-hexyl-8-oxo-7H-purine-6-carboxamide CAS Name: 9-(4-ethoxyphenyl)-2-hexyl-8-oxo-7H-purine-6-carboxamide IUPAC Name: 9-(4-ethoxyphenyl)-2-hexyl-8-oxo-7H-purine-6-carboxamide Traditional Name: 2-hexyl-8-keto-9-p-phenetyl-7H-purine-6-carboxamide Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=NC(=C2C(=N1)N(C(=O)N2)C3=CC=C(C=C3)OCC)C(=O)N

Isomeric SMILES

CCCCCCC1=NC(=C2C(=N1)N(C(=O)N2)C3=CC=C(C=C3)OCC)C(=O)N

InChI

InChI=1S/C20H25N5O3/c1-3-5-6-7-8-15-22-16(18(21)26)17-19(23-15)25(20(27)24-17)13-9-11-14(12-10-13)28-4-2/h9-12H,3-8H2,1-2H3,(H2,21,26)(H,24,27)