9-(3,4-dihydro-2H-chromen-4-yl)-2-(6-fluoranylbenzimidazol-1-yl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 9-(3,4-dihydro-2H-chromen-4-yl)-2-(6-fluoranylbenzimidazol-1-yl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 9-chroman-4-yl-2-(6-fluorobenzimidazol-1-yl)-8-oxo-7H-purine-6-carboxamide CAS Name: 9-(3,4-dihydro-2H-1-benzopyran-4-yl)-2-(6-fluoro-1-benzimidazolyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 9-(3,4-dihydro-2H-chromen-4-yl)-2-(6-fluorobenzimidazol-1-yl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 9-chroman-4-yl-2-(6-fluorobenzimidazol-1-yl)-8-keto-7H-purine-6-carboxamide Formula: C22H16FN7O3 MolecularWeight: 445.405943

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2C1N3C4=NC(=NC(=C4NC3=O)C(=O)N)N5C=NC6=C5C=C(C=C6)F

Isomeric SMILES

C1COC2=CC=CC=C2C1N3C4=NC(=NC(=C4NC3=O)C(=O)N)N5C=NC6=C5C=C(C=C6)F

InChI

InChI=1S/C22H16FN7O3/c23-11-5-6-13-15(9-11)29(10-25-13)21-26-17(19(24)31)18-20(28-21)30(22(32)27-18)14-7-8-33-16-4-2-1-3-12(14)16/h1-6,9-10,14H,7-8H2,(H2,24,31)(H,27,32)