1-(1,3-dimethyl-4-phenyl-imidazol-1-ium-2-yl)sulfanylpropan-2-one

Systemtic Name: 1-(1,3-dimethyl-4-phenyl-imidazol-1-ium-2-yl)sulfanylpropan-2-one Openeye Name: 1-(1,3-dimethyl-4-phenyl-imidazol-1-ium-2-yl)sulfanylpropan-2-one CAS Name: 1-[(1,3-dimethyl-4-phenyl-2-imidazol-1-iumyl)thio]-2-propanone IUPAC Name: 1-(1,3-dimethyl-4-phenylimidazol-1-ium-2-yl)sulfanylpropan-2-one Traditional Name: 1-[(1,3-dimethyl-4-phenyl-imidazol-1-ium-2-yl)thio]acetone Formula: C14H17N2OS+ MolecularWeight: 261.36258

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=[N+](C=C(N1C)C2=CC=CC=C2)C

Isomeric SMILES

CC(=O)CSC1=[N+](C=C(N1C)C2=CC=CC=C2)C

InChI

InChI=1S/C14H17N2OS/c1-11(17)10-18-14-15(2)9-13(16(14)3)12-7-5-4-6-8-12/h4-9H,10H2,1-3H3/q+1