2-[[4-[3,4-bis(oxidanyl)phenyl]-3-methyl-1,3-thiazol-3-ium-2-yl]sulfanyl]-1-phenyl-ethanone

Systemtic Name: 2-[[4-[3,4-bis(oxidanyl)phenyl]-3-methyl-1,3-thiazol-3-ium-2-yl]sulfanyl]-1-phenyl-ethanone Openeye Name: 2-[4-(3,4-dihydroxyphenyl)-3-methyl-thiazol-3-ium-2-yl]sulfanyl-1-phenyl-ethanone CAS Name: 2-[[4-(3,4-dihydroxyphenyl)-3-methyl-2-thiazol-3-iumyl]thio]-1-phenylethanone IUPAC Name: 2-[[4-(3,4-dihydroxyphenyl)-3-methyl-1,3-thiazol-3-ium-2-yl]sulfanyl]-1-phenylethanone Traditional Name: 2-[[4-(3,4-dihydroxyphenyl)-3-methyl-thiazol-3-ium-2-yl]thio]-1-phenyl-ethanone Formula: C18H16NO3S2+ MolecularWeight: 358.45454

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(SC=C1C2=CC(=C(C=C2)O)O)SCC(=O)C3=CC=CC=C3

Isomeric SMILES

C[N+]1=C(SC=C1C2=CC(=C(C=C2)O)O)SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H15NO3S2/c1-19-14(13-7-8-15(20)16(21)9-13)10-23-18(19)24-11-17(22)12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H-,20,21)/p+1