3-ethyl-1,3-thiazol-3-ium-2-amine; 4-methylbenzenesulfonate

Systemtic Name: 3-ethyl-1,3-thiazol-3-ium-2-amine; 4-methylbenzenesulfonate Openeye Name: 3-ethylthiazol-3-ium-2-amine; 4-methylbenzenesulfonate CAS Name: 3-ethyl-2-thiazol-3-iumamine; 4-methylbenzenesulfonate IUPAC Name: 3-ethyl-1,3-thiazol-3-ium-2-amine; 4-methylbenzenesulfonate Traditional Name: (3-ethylthiazol-3-ium-2-yl)amine tosylate Formula: C12H16N2O3S2 MolecularWeight: 300.39704

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(SC=C1)N.CC1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CC[N+]1=C(SC=C1)N.CC1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C7H8O3S.C5H8N2S/c1-6-2-4-7(5-3-6)11(8,9)10;1-2-7-3-4-8-5(7)6/h2-5H,1H3,(H,8,9,10);3-4,6H,2H2,1H3