4-[3-(6-cyclopropyl-4-methyl-pyridin-3-yl)phenyl]-7-ethoxy-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one

Systemtic Name: 4-[3-(6-cyclopropyl-4-methyl-pyridin-3-yl)phenyl]-7-ethoxy-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 4-[3-(6-cyclopropyl-4-methyl-3-pyridyl)phenyl]-7-ethoxy-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 4-[3-(6-cyclopropyl-4-methyl-3-pyridinyl)phenyl]-7-ethoxy-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 4-[3-(6-cyclopropyl-4-methylpyridin-3-yl)phenyl]-7-ethoxy-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 4-[3-(6-cyclopropyl-4-methyl-3-pyridyl)phenyl]-7-ethoxy-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C27H24F3N3O2 MolecularWeight: 479.49357

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1C(F)(F)F)NC(=O)CC(=N2)C3=CC=CC(=C3)C4=CN=C(C=C4C)C5CC5

Isomeric SMILES

CCOC1=CC2=C(C=C1C(F)(F)F)NC(=O)CC(=N2)C3=CC=CC(=C3)C4=CN=C(C=C4C)C5CC5

InChI

InChI=1S/C27H24F3N3O2/c1-3-35-25-12-24-23(11-20(25)27(28,29)30)33-26(34)13-22(32-24)18-6-4-5-17(10-18)19-14-31-21(9-15(19)2)16-7-8-16/h4-6,9-12,14,16H,3,7-8,13H2,1-2H3,(H,33,34)