N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-3-chloranyl-2-fluoranyl-6-(trifluoromethyl)benzamide

Systemtic Name: N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-3-chloranyl-2-fluoranyl-6-(trifluoromethyl)benzamide Openeye Name: N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-3-chloro-2-fluoro-6-(trifluoromethyl)benzamide CAS Name: N-[1-(1-benzotriazolylmethyl)-4-pyrazolyl]-3-chloro-2-fluoro-6-(trifluoromethyl)benzamide IUPAC Name: N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-3-chloro-2-fluoro-6-(trifluoromethyl)benzamide Traditional Name: N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-3-chloro-2-fluoro-6-(trifluoromethyl)benzamide Formula: C18H11ClF4N6O MolecularWeight: 438.766153

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CN3C=C(C=N3)NC(=O)C4=C(C=CC(=C4F)Cl)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CN3C=C(C=N3)NC(=O)C4=C(C=CC(=C4F)Cl)C(F)(F)F

InChI

InChI=1S/C18H11ClF4N6O/c19-12-6-5-11(18(21,22)23)15(16(12)20)17(30)25-10-7-24-28(8-10)9-29-14-4-2-1-3-13(14)26-27-29/h1-8H,9H2,(H,25,30)