4-[6-[4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]pyridin-3-yl]sulfonylmorpholine

Systemtic Name: 4-[6-[4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]pyridin-3-yl]sulfonylmorpholine Openeye Name: 4-[[6-[4-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-1-yl]-3-pyridyl]sulfonyl]morpholine CAS Name: 4-[[6-[4-[5-(trifluoromethyl)-2-pyridinyl]-1,4-diazepan-1-yl]-3-pyridinyl]sulfonyl]morpholine IUPAC Name: 4-[6-[4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]pyridin-3-yl]sulfonylmorpholine Traditional Name: 4-[[6-[4-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-1-yl]-3-pyridyl]sulfonyl]morpholine Formula: C20H24F3N5O3S MolecularWeight: 471.49647

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C2=NC=C(C=C2)S(=O)(=O)N3CCOCC3)C4=NC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN(C1)C2=NC=C(C=C2)S(=O)(=O)N3CCOCC3)C4=NC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C20H24F3N5O3S/c21-20(22,23)16-2-4-18(24-14-16)26-6-1-7-27(9-8-26)19-5-3-17(15-25-19)32(29,30)28-10-12-31-13-11-28/h2-5,14-15H,1,6-13H2