2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]-1-morpholin-4-yl-ethanone

Systemtic Name: 2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]-1-morpholin-4-yl-ethanone Openeye Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]-1-morpholino-ethanone CAS Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]-1-morpholin-4-ylethanone Traditional Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]-1-morpholino-ethanone Formula: C14H16BrNO4S MolecularWeight: 374.25014

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CSCC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

C1COCCN1C(=O)CSCC2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C14H16BrNO4S/c15-11-6-13-12(19-9-20-13)5-10(11)7-21-8-14(17)16-1-3-18-4-2-16/h5-6H,1-4,7-9H2