2-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]-2-(7-bromanyl-1,3-benzodioxol-5-yl)ethanamine

Systemtic Name: 2-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]-2-(7-bromanyl-1,3-benzodioxol-5-yl)ethanamine Openeye Name: 2-(7-bromo-1,3-benzodioxol-5-yl)-2-(1,1-dioxo-1,4-thiazinan-4-yl)ethanamine CAS Name: 2-(7-bromo-1,3-benzodioxol-5-yl)-2-(1,1-dioxo-1,4-thiazinan-4-yl)ethanamine IUPAC Name: 2-(7-bromo-1,3-benzodioxol-5-yl)-2-(1,1-dioxo-1,4-thiazinan-4-yl)ethanamine Traditional Name: [2-(7-bromo-1,3-benzodioxol-5-yl)-2-(1,1-diketo-1,4-thiazinan-4-yl)ethyl]amine Formula: C13H17BrN2O4S MolecularWeight: 377.25408

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCN1C(CN)C2=CC3=C(C(=C2)Br)OCO3

Isomeric SMILES

C1CS(=O)(=O)CCN1C(CN)C2=CC3=C(C(=C2)Br)OCO3

InChI

InChI=1S/C13H17BrN2O4S/c14-10-5-9(6-12-13(10)20-8-19-12)11(7-15)16-1-3-21(17,18)4-2-16/h5-6,11H,1-4,7-8,15H2