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

Systemtic Name: 4-[3-(5-ethyl-2-methyl-pyridin-4-yl)phenyl]-7-methyl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 4-[3-(5-ethyl-2-methyl-4-pyridyl)phenyl]-7-methyl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 4-[3-(5-ethyl-2-methyl-4-pyridinyl)phenyl]-7-methyl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 4-[3-(5-ethyl-2-methylpyridin-4-yl)phenyl]-7-methyl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 4-[3-(5-ethyl-2-methyl-4-pyridyl)phenyl]-7-methyl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C25H22F3N3O MolecularWeight: 437.45689

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C=C1C2=CC(=CC=C2)C3=NC4=C(C=C(C(=C4)C)C(F)(F)F)NC(=O)C3)C

Isomeric SMILES

CCC1=CN=C(C=C1C2=CC(=CC=C2)C3=NC4=C(C=C(C(=C4)C)C(F)(F)F)NC(=O)C3)C

InChI

InChI=1S/C25H22F3N3O/c1-4-16-13-29-15(3)9-19(16)17-6-5-7-18(10-17)21-12-24(32)31-23-11-20(25(26,27)28)14(2)8-22(23)30-21/h5-11,13H,4,12H2,1-3H3,(H,31,32)