3-[4-[(1-cyanocyclohexyl)carbamoyl]phenyl]-N-cyclopropyl-5-fluoranyl-4-methyl-benzamide

Systemtic Name: 3-[4-[(1-cyanocyclohexyl)carbamoyl]phenyl]-N-cyclopropyl-5-fluoranyl-4-methyl-benzamide Openeye Name: 3-[4-[(1-cyanocyclohexyl)carbamoyl]phenyl]-N-cyclopropyl-5-fluoro-4-methyl-benzamide CAS Name: 3-[4-[[(1-cyanocyclohexyl)amino]-oxomethyl]phenyl]-N-cyclopropyl-5-fluoro-4-methylbenzamide IUPAC Name: 3-[4-[(1-cyanocyclohexyl)carbamoyl]phenyl]-N-cyclopropyl-5-fluoro-4-methylbenzamide Traditional Name: 3-[4-[(1-cyanocyclohexyl)carbamoyl]phenyl]-N-cyclopropyl-5-fluoro-4-methyl-benzamide Formula: C25H26FN3O2 MolecularWeight: 419.491243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C2=CC=C(C=C2)C(=O)NC3(CCCCC3)C#N)C(=O)NC4CC4)F

Isomeric SMILES

CC1=C(C=C(C=C1C2=CC=C(C=C2)C(=O)NC3(CCCCC3)C#N)C(=O)NC4CC4)F

InChI

InChI=1S/C25H26FN3O2/c1-16-21(13-19(14-22(16)26)23(30)28-20-9-10-20)17-5-7-18(8-6-17)24(31)29-25(15-27)11-3-2-4-12-25/h5-8,13-14,20H,2-4,9-12H2,1H3,(H,28,30)(H,29,31)