2-methylsulfanyl-3-prop-2-ynyl-2H-1,3-benzothiazole bromide

Systemtic Name: 2-methylsulfanyl-3-prop-2-ynyl-2H-1,3-benzothiazole bromide Openeye Name: 2-methylsulfanyl-3-prop-2-ynyl-2H-1,3-benzothiazole bromide CAS Name: 2-(methylthio)-3-prop-2-ynyl-2H-1,3-benzothiazole bromide IUPAC Name: 2-methylsulfanyl-3-prop-2-ynyl-2H-1,3-benzothiazole bromide Traditional Name: 2-(methylthio)-3-propargyl-2H-1,3-benzothiazole bromide Formula: C11H11BrNS2- MolecularWeight: 301.24574

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Descriptors Computed from Structure

Canonical SMILES:

CSC1N(C2=CC=CC=C2S1)CC#C.[Br-]

Isomeric SMILES

CSC1N(C2=CC=CC=C2S1)CC#C.[Br-]

InChI

InChI=1S/C11H11NS2.BrH/c1-3-8-12-9-6-4-5-7-10(9)14-11(12)13-2;/h1,4-7,11H,8H2,2H3;1H/p-1