2-[4-(1-adamantylcarbonylamino)-2-(trifluoromethyl)phenyl]-N-pyridin-2-yl-3H-benzimidazole-5-carboxamide

Systemtic Name: 2-[4-(1-adamantylcarbonylamino)-2-(trifluoromethyl)phenyl]-N-pyridin-2-yl-3H-benzimidazole-5-carboxamide Openeye Name: 2-[4-(adamantane-1-carbonylamino)-2-(trifluoromethyl)phenyl]-N-(2-pyridyl)-3H-benzimidazole-5-carboxamide CAS Name: 2-[4-[[1-adamantyl(oxo)methyl]amino]-2-(trifluoromethyl)phenyl]-N-(2-pyridinyl)-3H-benzimidazole-5-carboxamide IUPAC Name: 2-[4-(adamantane-1-carbonylamino)-2-(trifluoromethyl)phenyl]-N-pyridin-2-yl-3H-benzimidazole-5-carboxamide Traditional Name: 2-[4-(adamantane-1-carbonylamino)-2-(trifluoromethyl)phenyl]-N-(2-pyridyl)-3H-benzimidazole-5-carboxamide Formula: C31H28F3N5O2 MolecularWeight: 559.58153

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=CC(=C(C=C4)C5=NC6=C(N5)C=C(C=C6)C(=O)NC7=CC=CC=N7)C(F)(F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=CC(=C(C=C4)C5=NC6=C(N5)C=C(C=C6)C(=O)NC7=CC=CC=N7)C(F)(F)F

InChI

InChI=1S/C31H28F3N5O2/c32-31(33,34)23-13-21(36-29(41)30-14-17-9-18(15-30)11-19(10-17)16-30)5-6-22(23)27-37-24-7-4-20(12-25(24)38-27)28(40)39-26-3-1-2-8-35-26/h1-8,12-13,17-19H,9-11,14-16H2,(H,36,41)(H,37,38)(H,35,39,40)