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

Systemtic Name: 4-[7-morpholin-4-yl-2-oxidanylidene-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]pyridine-2-carbonitrile Openeye Name: 4-[7-morpholino-2-oxo-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]pyridine-2-carbonitrile CAS Name: 4-[7-(4-morpholinyl)-2-oxo-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]-2-pyridinecarbonitrile IUPAC Name: 4-[7-morpholin-4-yl-2-oxo-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]pyridine-2-carbonitrile Traditional Name: 4-[2-keto-7-morpholino-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]picolinonitrile Formula: C20H16F3N5O2 MolecularWeight: 415.36855

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC3=C(C=C2C(F)(F)F)NC(=O)CC(=N3)C4=CC(=NC=C4)C#N

Isomeric SMILES

C1COCCN1C2=CC3=C(C=C2C(F)(F)F)NC(=O)CC(=N3)C4=CC(=NC=C4)C#N

InChI

InChI=1S/C20H16F3N5O2/c21-20(22,23)14-8-16-17(9-18(14)28-3-5-30-6-4-28)26-15(10-19(29)27-16)12-1-2-25-13(7-12)11-24/h1-2,7-9H,3-6,10H2,(H,27,29)