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

Systemtic Name: 4-[7-(dimethylamino)-2-oxidanylidene-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]pyridine-2-carbonitrile Openeye Name: 4-[7-(dimethylamino)-2-oxo-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]pyridine-2-carbonitrile CAS Name: 4-[7-(dimethylamino)-2-oxo-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]-2-pyridinecarbonitrile IUPAC Name: 4-[7-(dimethylamino)-2-oxo-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]pyridine-2-carbonitrile Traditional Name: 4-[7-(dimethylamino)-2-keto-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]picolinonitrile Formula: C18H14F3N5O MolecularWeight: 373.33187

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1C(F)(F)F)NC(=O)CC(=N2)C3=CC(=NC=C3)C#N

Isomeric SMILES

CN(C)C1=CC2=C(C=C1C(F)(F)F)NC(=O)CC(=N2)C3=CC(=NC=C3)C#N

InChI

InChI=1S/C18H14F3N5O/c1-26(2)16-7-15-14(6-12(16)18(19,20)21)25-17(27)8-13(24-15)10-3-4-23-11(5-10)9-22/h3-7H,8H2,1-2H3,(H,25,27)