1-[4-(2-azidoethyl)phenyl]-6-chloranyl-2-pyridin-2-yl-5-(trifluoromethyl)benzimidazole

Systemtic Name: 1-[4-(2-azidoethyl)phenyl]-6-chloranyl-2-pyridin-2-yl-5-(trifluoromethyl)benzimidazole Openeye Name: 1-[4-(2-azidoethyl)phenyl]-6-chloro-2-(2-pyridyl)-5-(trifluoromethyl)benzimidazole CAS Name: 1-[4-(2-azidoethyl)phenyl]-6-chloro-2-(2-pyridinyl)-5-(trifluoromethyl)benzimidazole IUPAC Name: 1-[4-(2-azidoethyl)phenyl]-6-chloro-2-pyridin-2-yl-5-(trifluoromethyl)benzimidazole Traditional Name: 1-[4-(2-azidoethyl)phenyl]-6-chloro-2-(2-pyridyl)-5-(trifluoromethyl)benzimidazole Formula: C21H14ClF3N6 MolecularWeight: 442.82427

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=NC3=C(N2C4=CC=C(C=C4)CCN=[N+]=[N-])C=C(C(=C3)C(F)(F)F)Cl

Isomeric SMILES

C1=CC=NC(=C1)C2=NC3=C(N2C4=CC=C(C=C4)CCN=[N+]=[N-])C=C(C(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C21H14ClF3N6/c22-16-12-19-18(11-15(16)21(23,24)25)29-20(17-3-1-2-9-27-17)31(19)14-6-4-13(5-7-14)8-10-28-30-26/h1-7,9,11-12H,8,10H2