9-(3,4-dihydro-2H-chromen-4-yl)-2-(6-fluoranylbenzimidazol-1-yl)-6-piperidin-1-ylcarbonyl-7H-purin-8-one

Systemtic Name: 9-(3,4-dihydro-2H-chromen-4-yl)-2-(6-fluoranylbenzimidazol-1-yl)-6-piperidin-1-ylcarbonyl-7H-purin-8-one Openeye Name: 9-chroman-4-yl-2-(6-fluorobenzimidazol-1-yl)-6-(piperidine-1-carbonyl)-7H-purin-8-one CAS Name: 9-(3,4-dihydro-2H-1-benzopyran-4-yl)-2-(6-fluoro-1-benzimidazolyl)-6-[oxo(1-piperidinyl)methyl]-7H-purin-8-one IUPAC Name: 9-(3,4-dihydro-2H-chromen-4-yl)-2-(6-fluorobenzimidazol-1-yl)-6-(piperidine-1-carbonyl)-7H-purin-8-one Traditional Name: 9-chroman-4-yl-2-(6-fluorobenzimidazol-1-yl)-6-(piperidine-1-carbonyl)-7H-purin-8-one Formula: C27H24FN7O3 MolecularWeight: 513.522963

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=C3C(=NC(=N2)N4C=NC5=C4C=C(C=C5)F)N(C(=O)N3)C6CCOC7=CC=CC=C67

Isomeric SMILES

C1CCN(CC1)C(=O)C2=C3C(=NC(=N2)N4C=NC5=C4C=C(C=C5)F)N(C(=O)N3)C6CCOC7=CC=CC=C67

InChI

InChI=1S/C27H24FN7O3/c28-16-8-9-18-20(14-16)34(15-29-18)26-30-23(25(36)33-11-4-1-5-12-33)22-24(32-26)35(27(37)31-22)19-10-13-38-21-7-3-2-6-17(19)21/h2-3,6-9,14-15,19H,1,4-5,10-13H2,(H,31,37)