N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-2-[4-fluoranyl-2-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-2-[4-fluoranyl-2-(trifluoromethyl)phenyl]ethanamide Openeye Name: N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-2-[4-fluoro-2-(trifluoromethyl)phenyl]acetamide CAS Name: N-[1-(1-benzotriazolylmethyl)-4-pyrazolyl]-2-[4-fluoro-2-(trifluoromethyl)phenyl]acetamide IUPAC Name: N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-2-[4-fluoro-2-(trifluoromethyl)phenyl]acetamide Traditional Name: N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-2-[4-fluoro-2-(trifluoromethyl)phenyl]acetamide Formula: C19H14F4N6O MolecularWeight: 418.347673

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CN3C=C(C=N3)NC(=O)CC4=C(C=C(C=C4)F)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CN3C=C(C=N3)NC(=O)CC4=C(C=C(C=C4)F)C(F)(F)F

InChI

InChI=1S/C19H14F4N6O/c20-13-6-5-12(15(8-13)19(21,22)23)7-18(30)25-14-9-24-28(10-14)11-29-17-4-2-1-3-16(17)26-27-29/h1-6,8-10H,7,11H2,(H,25,30)