2-[[4-(4-methylphenyl)sulfonylphenyl]methylsulfanyl]-1-oxidanidyl-pyridin-1-ium

Systemtic Name: 2-[[4-(4-methylphenyl)sulfonylphenyl]methylsulfanyl]-1-oxidanidyl-pyridin-1-ium Openeye Name: 1-oxido-2-[[4-(p-tolylsulfonyl)phenyl]methylsulfanyl]pyridin-1-ium CAS Name: 2-[[4-(4-methylphenyl)sulfonylphenyl]methylthio]-1-oxidopyridin-1-ium IUPAC Name: 2-[[4-(4-methylphenyl)sulfonylphenyl]methylsulfanyl]-1-oxidopyridin-1-ium Traditional Name: 1-oxido-2-[(4-tosylbenzyl)thio]pyridin-1-ium Formula: C19H17NO3S2 MolecularWeight: 371.47318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)CSC3=CC=CC=[N+]3[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)CSC3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C19H17NO3S2/c1-15-5-9-17(10-6-15)25(22,23)18-11-7-16(8-12-18)14-24-19-4-2-3-13-20(19)21/h2-13H,14H2,1H3