N-[1-[(3-cyano-5-fluoranyl-phenyl)methyl]-4-methyl-1,4-diazepan-6-yl]-1H-indazole-3-carboxamide

Systemtic Name: N-[1-[(3-cyano-5-fluoranyl-phenyl)methyl]-4-methyl-1,4-diazepan-6-yl]-1H-indazole-3-carboxamide Openeye Name: N-[1-[(3-cyano-5-fluoro-phenyl)methyl]-4-methyl-1,4-diazepan-6-yl]-1H-indazole-3-carboxamide CAS Name: N-[1-[(3-cyano-5-fluorophenyl)methyl]-4-methyl-1,4-diazepan-6-yl]-1H-indazole-3-carboxamide IUPAC Name: N-[1-[(3-cyano-5-fluorophenyl)methyl]-4-methyl-1,4-diazepan-6-yl]-1H-indazole-3-carboxamide Traditional Name: N-[1-(3-cyano-5-fluoro-benzyl)-4-methyl-1,4-diazepan-6-yl]-1H-indazole-3-carboxamide Formula: C22H23FN6O MolecularWeight: 406.456023

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC(C1)NC(=O)C2=NNC3=CC=CC=C32)CC4=CC(=CC(=C4)C#N)F

Isomeric SMILES

CN1CCN(CC(C1)NC(=O)C2=NNC3=CC=CC=C32)CC4=CC(=CC(=C4)C#N)F

InChI

InChI=1S/C22H23FN6O/c1-28-6-7-29(12-16-8-15(11-24)9-17(23)10-16)14-18(13-28)25-22(30)21-19-4-2-3-5-20(19)26-27-21/h2-5,8-10,18H,6-7,12-14H2,1H3,(H,25,30)(H,26,27)