N-(3-imidazol-1-ylpropyl)-1-[[2-(trifluoromethyl)phenyl]carbamoylamino]cyclohexane-1-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-1-[[2-(trifluoromethyl)phenyl]carbamoylamino]cyclohexane-1-carboxamide Openeye Name: N-(3-imidazol-1-ylpropyl)-1-[[2-(trifluoromethyl)phenyl]carbamoylamino]cyclohexanecarboxamide CAS Name: N-[3-(1-imidazolyl)propyl]-1-[[oxo-[2-(trifluoromethyl)anilino]methyl]amino]-1-cyclohexanecarboxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-1-[[2-(trifluoromethyl)phenyl]carbamoylamino]cyclohexane-1-carboxamide Traditional Name: N-(3-imidazol-1-ylpropyl)-1-[[2-(trifluoromethyl)phenyl]carbamoylamino]cyclohexanecarboxamide Formula: C21H26F3N5O2 MolecularWeight: 437.45865

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)NCCCN2C=CN=C2)NC(=O)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1CCC(CC1)(C(=O)NCCCN2C=CN=C2)NC(=O)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C21H26F3N5O2/c22-21(23,24)16-7-2-3-8-17(16)27-19(31)28-20(9-4-1-5-10-20)18(30)26-11-6-13-29-14-12-25-15-29/h2-3,7-8,12,14-15H,1,4-6,9-11,13H2,(H,26,30)(H2,27,28,31)