1-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)-3,3-dimethyl-butan-2-one

Systemtic Name: 1-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)-3,3-dimethyl-butan-2-one Openeye Name: 1-(4,5-dimethylthiazol-3-ium-3-yl)-3,3-dimethyl-butan-2-one CAS Name: 1-(4,5-dimethyl-3-thiazol-3-iumyl)-3,3-dimethyl-2-butanone IUPAC Name: 1-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)-3,3-dimethylbutan-2-one Traditional Name: 1-(4,5-dimethylthiazol-3-ium-3-yl)-3,3-dimethyl-butan-2-one Formula: C11H18NOS+ MolecularWeight: 212.33172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=[N+]1CC(=O)C(C)(C)C)C

Isomeric SMILES

CC1=C(SC=[N+]1CC(=O)C(C)(C)C)C

InChI

InChI=1S/C11H18NOS/c1-8-9(2)14-7-12(8)6-10(13)11(3,4)5/h7H,6H2,1-5H3/q+1