4-[3-(6-ethylpyridin-3-yl)phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one

Systemtic Name: 4-[3-(6-ethylpyridin-3-yl)phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 4-[3-(6-ethyl-3-pyridyl)phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 4-[3-(6-ethyl-3-pyridinyl)phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 4-[3-(6-ethylpyridin-3-yl)phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 4-[3-(6-ethyl-3-pyridyl)phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C23H18F3N3O MolecularWeight: 409.40373

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=C(C=C1)C2=CC(=CC=C2)C3=NC4=C(C=C(C=C4)C(F)(F)F)NC(=O)C3

Isomeric SMILES

CCC1=NC=C(C=C1)C2=CC(=CC=C2)C3=NC4=C(C=C(C=C4)C(F)(F)F)NC(=O)C3

InChI

InChI=1S/C23H18F3N3O/c1-2-18-8-6-16(13-27-18)14-4-3-5-15(10-14)20-12-22(30)29-21-11-17(23(24,25)26)7-9-19(21)28-20/h3-11,13H,2,12H2,1H3,(H,29,30)