4-[3-[7-ethyl-2-oxidanylidene-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]phenyl]pyridine-2-carbonitrile

Systemtic Name: 4-[3-[7-ethyl-2-oxidanylidene-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]phenyl]pyridine-2-carbonitrile Openeye Name: 4-[3-[7-ethyl-2-oxo-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]phenyl]pyridine-2-carbonitrile CAS Name: 4-[3-[7-ethyl-2-oxo-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]phenyl]-2-pyridinecarbonitrile IUPAC Name: 4-[3-[7-ethyl-2-oxo-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]phenyl]pyridine-2-carbonitrile Traditional Name: 4-[3-[7-ethyl-2-keto-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]phenyl]picolinonitrile Formula: C24H17F3N4O MolecularWeight: 434.41319

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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=CC(=NC=C4)C#N

Isomeric SMILES

CCC1=CC2=C(C=C1C(F)(F)F)NC(=O)CC(=N2)C3=CC=CC(=C3)C4=CC(=NC=C4)C#N

InChI

InChI=1S/C24H17F3N4O/c1-2-14-10-21-22(11-19(14)24(25,26)27)31-23(32)12-20(30-21)17-5-3-4-15(8-17)16-6-7-29-18(9-16)13-28/h3-11H,2,12H2,1H3,(H,31,32)