N-(pyridin-3-ylmethyl)-2-[4-(trifluoromethyl)phenyl]-1,3-benzoxazole-5-carboxamide

Systemtic Name: N-(pyridin-3-ylmethyl)-2-[4-(trifluoromethyl)phenyl]-1,3-benzoxazole-5-carboxamide Openeye Name: N-(3-pyridylmethyl)-2-[4-(trifluoromethyl)phenyl]-1,3-benzoxazole-5-carboxamide CAS Name: N-(3-pyridinylmethyl)-2-[4-(trifluoromethyl)phenyl]-1,3-benzoxazole-5-carboxamide IUPAC Name: N-(pyridin-3-ylmethyl)-2-[4-(trifluoromethyl)phenyl]-1,3-benzoxazole-5-carboxamide Traditional Name: N-(3-pyridylmethyl)-2-[4-(trifluoromethyl)phenyl]-1,3-benzoxazole-5-carboxamide Formula: C21H14F3N3O2 MolecularWeight: 397.34997

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC(=O)C2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1=CC(=CN=C1)CNC(=O)C2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C21H14F3N3O2/c22-21(23,24)16-6-3-14(4-7-16)20-27-17-10-15(5-8-18(17)29-20)19(28)26-12-13-2-1-9-25-11-13/h1-11H,12H2,(H,26,28)