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

Systemtic Name: 2-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)-1-phenyl-butan-1-one Openeye Name: 2-(4,5-dimethylthiazol-3-ium-3-yl)-1-phenyl-butan-1-one CAS Name: 2-(4,5-dimethyl-3-thiazol-3-iumyl)-1-phenyl-1-butanone IUPAC Name: 2-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)-1-phenylbutan-1-one Traditional Name: 2-(4,5-dimethylthiazol-3-ium-3-yl)-1-phenyl-butan-1-one Formula: C15H18NOS+ MolecularWeight: 260.37452

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC=CC=C1)[N+]2=CSC(=C2C)C

Isomeric SMILES

CCC(C(=O)C1=CC=CC=C1)[N+]2=CSC(=C2C)C

InChI

InChI=1S/C15H18NOS/c1-4-14(16-10-18-12(3)11(16)2)15(17)13-8-6-5-7-9-13/h5-10,14H,4H2,1-3H3/q+1