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

Systemtic Name: 4-[3-(2-cyclopropylpyridin-3-yl)phenyl]-7-methyl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 4-[3-(2-cyclopropyl-3-pyridyl)phenyl]-7-methyl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 4-[3-(2-cyclopropyl-3-pyridinyl)phenyl]-7-methyl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 4-[3-(2-cyclopropylpyridin-3-yl)phenyl]-7-methyl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 4-[3-(2-cyclopropyl-3-pyridyl)phenyl]-7-methyl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C25H20F3N3O MolecularWeight: 435.44101

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C(F)(F)F)NC(=O)CC(=N2)C3=CC=CC(=C3)C4=C(N=CC=C4)C5CC5

Isomeric SMILES

CC1=CC2=C(C=C1C(F)(F)F)NC(=O)CC(=N2)C3=CC=CC(=C3)C4=C(N=CC=C4)C5CC5

InChI

InChI=1S/C25H20F3N3O/c1-14-10-21-22(12-19(14)25(26,27)28)31-23(32)13-20(30-21)17-5-2-4-16(11-17)18-6-3-9-29-24(18)15-7-8-15/h2-6,9-12,15H,7-8,13H2,1H3,(H,31,32)