2-methoxy-4-methyl-3-prop-2-ynyl-1,3-thiazol-3-ium bromide

Systemtic Name: 2-methoxy-4-methyl-3-prop-2-ynyl-1,3-thiazol-3-ium bromide Openeye Name: 2-methoxy-4-methyl-3-prop-2-ynyl-thiazol-3-ium bromide CAS Name: 2-methoxy-4-methyl-3-prop-2-ynylthiazol-3-ium bromide IUPAC Name: 2-methoxy-4-methyl-3-prop-2-ynyl-1,3-thiazol-3-ium bromide Traditional Name: 2-methoxy-4-methyl-3-propargyl-thiazol-3-ium bromide Formula: C8H10BrNOS MolecularWeight: 248.1401

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=[N+]1CC#C)OC.[Br-]

Isomeric SMILES

CC1=CSC(=[N+]1CC#C)OC.[Br-]

InChI

InChI=1S/C8H10NOS.BrH/c1-4-5-9-7(2)6-11-8(9)10-3;/h1,6H,5H2,2-3H3;1H/q+1;/p-1