4,5-dihydro-1,3-thiazol-3-ium; 4-methylbenzenesulfonate

Systemtic Name: 4,5-dihydro-1,3-thiazol-3-ium; 4-methylbenzenesulfonate Openeye Name: 4,5-dihydrothiazol-3-ium; 4-methylbenzenesulfonate CAS Name: 4,5-dihydrothiazol-3-ium; 4-methylbenzenesulfonate IUPAC Name: 4,5-dihydro-1,3-thiazol-3-ium; 4-methylbenzenesulfonate Traditional Name: 2-thiazolin-3-ium tosylate Formula: C10H13NO3S2 MolecularWeight: 259.34512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1CSC=[NH+]1

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1CSC=[NH+]1

InChI

InChI=1S/C7H8O3S.C3H5NS/c1-6-2-4-7(5-3-6)11(8,9)10;1-2-5-3-4-1/h2-5H,1H3,(H,8,9,10);3H,1-2H2