5-(4-methylphenyl)sulfonylimino-4-pyridin-1-ium-1-yl-2H-thiophen-3-olate

Systemtic Name: 5-(4-methylphenyl)sulfonylimino-4-pyridin-1-ium-1-yl-2H-thiophen-3-olate Openeye Name: 5-(p-tolylsulfonylimino)-4-pyridin-1-ium-1-yl-2H-thiophen-3-olate CAS Name: 5-(4-methylphenyl)sulfonylimino-4-(1-pyridin-1-iumyl)-2H-thiophen-3-olate IUPAC Name: 5-(4-methylphenyl)sulfonylimino-4-pyridin-1-ium-1-yl-2H-thiophen-3-olate Traditional Name: 4-pyridin-1-ium-1-yl-5-tosylimino-2H-thiophen-3-olate Formula: C16H14N2O3S2 MolecularWeight: 346.42396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C2C(=C(CS2)[O-])[N+]3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N=C2C(=C(CS2)[O-])[N+]3=CC=CC=C3

InChI

InChI=1S/C16H14N2O3S2/c1-12-5-7-13(8-6-12)23(20,21)17-16-15(14(19)11-22-16)18-9-3-2-4-10-18/h2-10H,11H2,1H3