4-[3-(6-cyclopropylpyridin-3-yl)phenyl]-7-ethyl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one

Systemtic Name: 4-[3-(6-cyclopropylpyridin-3-yl)phenyl]-7-ethyl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 4-[3-(6-cyclopropyl-3-pyridyl)phenyl]-7-ethyl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 4-[3-(6-cyclopropyl-3-pyridinyl)phenyl]-7-ethyl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 4-[3-(6-cyclopropylpyridin-3-yl)phenyl]-7-ethyl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 4-[3-(6-cyclopropyl-3-pyridyl)phenyl]-7-ethyl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C26H22F3N3O MolecularWeight: 449.46759

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1C(F)(F)F)NC(=O)CC(=N2)C3=CC=CC(=C3)C4=CN=C(C=C4)C5CC5

Isomeric SMILES

CCC1=CC2=C(C=C1C(F)(F)F)NC(=O)CC(=N2)C3=CC=CC(=C3)C4=CN=C(C=C4)C5CC5

InChI

InChI=1S/C26H22F3N3O/c1-2-15-11-23-24(12-20(15)26(27,28)29)32-25(33)13-22(31-23)18-5-3-4-17(10-18)19-8-9-21(30-14-19)16-6-7-16/h3-5,8-12,14,16H,2,6-7,13H2,1H3,(H,32,33)