4-[3-(2-methylpyridin-4-yl)phenyl]-8-(trifluoromethyloxy)-1,3-dihydro-1,5-benzodiazepin-2-one

Systemtic Name: 4-[3-(2-methylpyridin-4-yl)phenyl]-8-(trifluoromethyloxy)-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 4-[3-(2-methyl-4-pyridyl)phenyl]-8-(trifluoromethoxy)-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 4-[3-(2-methyl-4-pyridinyl)phenyl]-8-(trifluoromethoxy)-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 4-[3-(2-methylpyridin-4-yl)phenyl]-8-(trifluoromethoxy)-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 4-[3-(2-methyl-4-pyridyl)phenyl]-8-(trifluoromethoxy)-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C22H16F3N3O2 MolecularWeight: 411.37655

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)C2=CC(=CC=C2)C3=NC4=C(C=C(C=C4)OC(F)(F)F)NC(=O)C3

Isomeric SMILES

CC1=NC=CC(=C1)C2=CC(=CC=C2)C3=NC4=C(C=C(C=C4)OC(F)(F)F)NC(=O)C3

InChI

InChI=1S/C22H16F3N3O2/c1-13-9-15(7-8-26-13)14-3-2-4-16(10-14)19-12-21(29)28-20-11-17(30-22(23,24)25)5-6-18(20)27-19/h2-11H,12H2,1H3,(H,28,29)