4-[6-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]pyridin-3-yl]sulfonylmorpholine

Systemtic Name: 4-[6-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]pyridin-3-yl]sulfonylmorpholine Openeye Name: 4-[[6-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-3-pyridyl]sulfonyl]morpholine CAS Name: 4-[[6-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-3-pyridinyl]sulfonyl]morpholine IUPAC Name: 4-[6-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]pyridin-3-yl]sulfonylmorpholine Traditional Name: 4-[[6-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-3-pyridyl]sulfonyl]morpholine Formula: C18H19BrN2O5S2 MolecularWeight: 487.38786

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CN=C(C=C2)SCC3=CC4=C(C=C3Br)OCCO4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CN=C(C=C2)SCC3=CC4=C(C=C3Br)OCCO4

InChI

InChI=1S/C18H19BrN2O5S2/c19-15-10-17-16(25-7-8-26-17)9-13(15)12-27-18-2-1-14(11-20-18)28(22,23)21-3-5-24-6-4-21/h1-2,9-11H,3-8,12H2