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

Systemtic Name: 4-[2-oxidanylidene-7-pyrrolidin-1-yl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]pyridine-2-carbonitrile Openeye Name: 4-[2-oxo-7-pyrrolidin-1-yl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]pyridine-2-carbonitrile CAS Name: 4-[2-oxo-7-(1-pyrrolidinyl)-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]-2-pyridinecarbonitrile IUPAC Name: 4-[2-oxo-7-pyrrolidin-1-yl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]pyridine-2-carbonitrile Traditional Name: 4-[2-keto-7-pyrrolidino-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]picolinonitrile Formula: C20H16F3N5O MolecularWeight: 399.36915

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC3=C(C=C2C(F)(F)F)NC(=O)CC(=N3)C4=CC(=NC=C4)C#N

Isomeric SMILES

C1CCN(C1)C2=CC3=C(C=C2C(F)(F)F)NC(=O)CC(=N3)C4=CC(=NC=C4)C#N

InChI

InChI=1S/C20H16F3N5O/c21-20(22,23)14-8-16-17(9-18(14)28-5-1-2-6-28)26-15(10-19(29)27-16)12-3-4-25-13(7-12)11-24/h3-4,7-9H,1-2,5-6,10H2,(H,27,29)