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

Systemtic Name: 7-ethoxy-4-[3-(2-ethylpyridin-4-yl)phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 7-ethoxy-4-[3-(2-ethyl-4-pyridyl)phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 7-ethoxy-4-[3-(2-ethyl-4-pyridinyl)phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 7-ethoxy-4-[3-(2-ethylpyridin-4-yl)phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 7-ethoxy-4-[3-(2-ethyl-4-pyridyl)phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C25H22F3N3O2 MolecularWeight: 453.45629

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H22F3N3O2/c1-3-18-11-16(8-9-29-18)15-6-5-7-17(10-15)20-14-24(32)31-21-12-19(25(26,27)28)23(33-4-2)13-22(21)30-20/h5-13H,3-4,14H2,1-2H3,(H,31,32)