N-[1-(cyanomethylamino)-3-cyclohexyl-1-oxidanylidene-propan-2-yl]-4-(trifluoromethyl)benzamide

Systemtic Name: N-[1-(cyanomethylamino)-3-cyclohexyl-1-oxidanylidene-propan-2-yl]-4-(trifluoromethyl)benzamide Openeye Name: N-[2-(cyanomethylamino)-1-(cyclohexylmethyl)-2-oxo-ethyl]-4-(trifluoromethyl)benzamide CAS Name: N-[1-(cyanomethylamino)-3-cyclohexyl-1-oxopropan-2-yl]-4-(trifluoromethyl)benzamide IUPAC Name: N-[1-(cyanomethylamino)-3-cyclohexyl-1-oxopropan-2-yl]-4-(trifluoromethyl)benzamide Traditional Name: N-[2-(cyanomethylamino)-1-(cyclohexylmethyl)-2-keto-ethyl]-4-(trifluoromethyl)benzamide Formula: C19H22F3N3O2 MolecularWeight: 381.39209

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)NCC#N)NC(=O)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

C1CCC(CC1)CC(C(=O)NCC#N)NC(=O)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C19H22F3N3O2/c20-19(21,22)15-8-6-14(7-9-15)17(26)25-16(18(27)24-11-10-23)12-13-4-2-1-3-5-13/h6-9,13,16H,1-5,11-12H2,(H,24,27)(H,25,26)