4-(4-methylphenyl)-5-(4-methylsulfonylphenyl)-3-oxidanidyl-1,2,3-thiadiazol-3-ium

Systemtic Name: 4-(4-methylphenyl)-5-(4-methylsulfonylphenyl)-3-oxidanidyl-1,2,3-thiadiazol-3-ium Openeye Name: 5-(4-methylsulfonylphenyl)-3-oxido-4-(p-tolyl)thiadiazol-3-ium CAS Name: 4-(4-methylphenyl)-5-(4-methylsulfonylphenyl)-3-oxidothiadiazol-3-ium IUPAC Name: 4-(4-methylphenyl)-5-(4-methylsulfonylphenyl)-3-oxidothiadiazol-3-ium Traditional Name: 5-(4-mesylphenyl)-3-oxido-4-(p-tolyl)thiadiazol-3-ium Formula: C16H14N2O3S2 MolecularWeight: 346.42396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SN=[N+]2[O-])C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SN=[N+]2[O-])C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C16H14N2O3S2/c1-11-3-5-12(6-4-11)15-16(22-17-18(15)19)13-7-9-14(10-8-13)23(2,20)21/h3-10H,1-2H3