4-[6-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)pyridin-3-yl]sulfonylmorpholine

Systemtic Name: 4-[6-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)pyridin-3-yl]sulfonylmorpholine Openeye Name: 4-[[6-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-3-pyridyl]sulfonyl]morpholine CAS Name: 4-[[6-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-3-pyridinyl]sulfonyl]morpholine IUPAC Name: 4-[6-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)pyridin-3-yl]sulfonylmorpholine Traditional Name: 4-[[6-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-3-pyridyl]sulfonyl]morpholine Formula: C18H20N2O5S2 MolecularWeight: 408.4918

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)SC3=NC=C(C=C3)S(=O)(=O)N4CCOCC4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)SC3=NC=C(C=C3)S(=O)(=O)N4CCOCC4)OC1

InChI

InChI=1S/C18H20N2O5S2/c21-27(22,20-6-10-23-11-7-20)15-3-5-18(19-13-15)26-14-2-4-16-17(12-14)25-9-1-8-24-16/h2-5,12-13H,1,6-11H2