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

Systemtic Name: 4-methyl-3-prop-2-ynyl-1,3-thiazol-3-ium bromide Openeye Name: 4-methyl-3-prop-2-ynyl-thiazol-3-ium bromide CAS Name: 4-methyl-3-prop-2-ynylthiazol-3-ium bromide IUPAC Name: 4-methyl-3-prop-2-ynyl-1,3-thiazol-3-ium bromide Traditional Name: 4-methyl-3-propargyl-thiazol-3-ium bromide Formula: C7H8BrNS MolecularWeight: 218.11412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H8NS.BrH/c1-3-4-8-6-9-5-7(8)2;/h1,5-6H,4H2,2H3;1H/q+1;/p-1