3-[1-[4-[2-(dimethylaminomethyl)imidazol-1-yl]-2-fluoranyl-phenyl]-6-oxidanylidene-purin-7-yl]benzamide

Systemtic Name: 3-[1-[4-[2-(dimethylaminomethyl)imidazol-1-yl]-2-fluoranyl-phenyl]-6-oxidanylidene-purin-7-yl]benzamide Openeye Name: 3-[1-[4-[2-(dimethylaminomethyl)imidazol-1-yl]-2-fluoro-phenyl]-6-oxo-purin-7-yl]benzamide CAS Name: 3-[1-[4-[2-(dimethylaminomethyl)-1-imidazolyl]-2-fluorophenyl]-6-oxo-7-purinyl]benzamide IUPAC Name: 3-[1-[4-[2-(dimethylaminomethyl)imidazol-1-yl]-2-fluorophenyl]-6-oxopurin-7-yl]benzamide Traditional Name: 3-[1-[4-[2-(dimethylaminomethyl)imidazol-1-yl]-2-fluoro-phenyl]-6-keto-purin-7-yl]benzamide Formula: C24H21FN8O2 MolecularWeight: 472.474343

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=NC=CN1C2=CC(=C(C=C2)N3C=NC4=C(C3=O)N(C=N4)C5=CC=CC(=C5)C(=O)N)F

Isomeric SMILES

CN(C)CC1=NC=CN1C2=CC(=C(C=C2)N3C=NC4=C(C3=O)N(C=N4)C5=CC=CC(=C5)C(=O)N)F

InChI

InChI=1S/C24H21FN8O2/c1-30(2)12-20-27-8-9-31(20)17-6-7-19(18(25)11-17)33-14-29-23-21(24(33)35)32(13-28-23)16-5-3-4-15(10-16)22(26)34/h3-11,13-14H,12H2,1-2H3,(H2,26,34)