N-(pyridin-3-ylmethyl)-1-[[4-(trifluoromethyl)phenyl]carbamoylamino]cyclohexane-1-carboxamide

Systemtic Name: N-(pyridin-3-ylmethyl)-1-[[4-(trifluoromethyl)phenyl]carbamoylamino]cyclohexane-1-carboxamide Openeye Name: N-(3-pyridylmethyl)-1-[[4-(trifluoromethyl)phenyl]carbamoylamino]cyclohexanecarboxamide CAS Name: 1-[[oxo-[4-(trifluoromethyl)anilino]methyl]amino]-N-(3-pyridinylmethyl)-1-cyclohexanecarboxamide IUPAC Name: N-(pyridin-3-ylmethyl)-1-[[4-(trifluoromethyl)phenyl]carbamoylamino]cyclohexane-1-carboxamide Traditional Name: N-(3-pyridylmethyl)-1-[[4-(trifluoromethyl)phenyl]carbamoylamino]cyclohexanecarboxamide Formula: C21H23F3N4O2 MolecularWeight: 420.42813

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)NCC2=CN=CC=C2)NC(=O)NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CCC(CC1)(C(=O)NCC2=CN=CC=C2)NC(=O)NC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C21H23F3N4O2/c22-21(23,24)16-6-8-17(9-7-16)27-19(30)28-20(10-2-1-3-11-20)18(29)26-14-15-5-4-12-25-13-15/h4-9,12-13H,1-3,10-11,14H2,(H,26,29)(H2,27,28,30)