7-(2-methylpropylamino)-4-(3-pyridin-4-ylphenyl)-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one

Systemtic Name: 7-(2-methylpropylamino)-4-(3-pyridin-4-ylphenyl)-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 7-(isobutylamino)-4-[3-(4-pyridyl)phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 7-(2-methylpropylamino)-4-(3-pyridin-4-ylphenyl)-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 7-(2-methylpropylamino)-4-(3-pyridin-4-ylphenyl)-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 7-(isobutylamino)-4-[3-(4-pyridyl)phenyl]-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C25H23F3N4O MolecularWeight: 452.47153

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=CC2=C(C=C1C(F)(F)F)NC(=O)CC(=N2)C3=CC=CC(=C3)C4=CC=NC=C4

Isomeric SMILES

CC(C)CNC1=CC2=C(C=C1C(F)(F)F)NC(=O)CC(=N2)C3=CC=CC(=C3)C4=CC=NC=C4

InChI

InChI=1S/C25H23F3N4O/c1-15(2)14-30-21-12-23-22(11-19(21)25(26,27)28)32-24(33)13-20(31-23)18-5-3-4-17(10-18)16-6-8-29-9-7-16/h3-12,15,30H,13-14H2,1-2H3,(H,32,33)