2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-1-phenyl-ethanone

Systemtic Name: 2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-1-phenyl-ethanone Openeye Name: 2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-1-phenyl-ethanone CAS Name: 2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)thio]-1-phenylethanone IUPAC Name: 2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-1-phenylethanone Traditional Name: 2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)thio]-1-phenyl-ethanone Formula: C16H15N2OS+ MolecularWeight: 283.3681

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)[NH+]=C(N2)SCC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC2=C(C=C1)[NH+]=C(N2)SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H14N2OS/c1-11-7-8-13-14(9-11)18-16(17-13)20-10-15(19)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,17,18)/p+1