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

Systemtic Name: 4-[7-methyl-2-oxidanylidene-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]pyridine-2-carbonitrile Openeye Name: 4-[7-methyl-2-oxo-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]pyridine-2-carbonitrile CAS Name: 4-[7-methyl-2-oxo-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]-2-pyridinecarbonitrile IUPAC Name: 4-[7-methyl-2-oxo-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]pyridine-2-carbonitrile Traditional Name: 4-[2-keto-7-methyl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]picolinonitrile Formula: C17H11F3N4O MolecularWeight: 344.29065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C(F)(F)F)NC(=O)CC(=N2)C3=CC(=NC=C3)C#N

Isomeric SMILES

CC1=CC2=C(C=C1C(F)(F)F)NC(=O)CC(=N2)C3=CC(=NC=C3)C#N

InChI

InChI=1S/C17H11F3N4O/c1-9-4-14-15(6-12(9)17(18,19)20)24-16(25)7-13(23-14)10-2-3-22-11(5-10)8-21/h2-6H,7H2,1H3,(H,24,25)