4-(6-methylpyridin-3-yl)-5-(4-methylsulfonylphenyl)-3-oxidanidyl-1,2,3-thiadiazol-3-ium

Systemtic Name: 4-(6-methylpyridin-3-yl)-5-(4-methylsulfonylphenyl)-3-oxidanidyl-1,2,3-thiadiazol-3-ium Openeye Name: 4-(6-methyl-3-pyridyl)-5-(4-methylsulfonylphenyl)-3-oxido-thiadiazol-3-ium CAS Name: 4-(6-methyl-3-pyridinyl)-5-(4-methylsulfonylphenyl)-3-oxidothiadiazol-3-ium IUPAC Name: 4-(6-methylpyridin-3-yl)-5-(4-methylsulfonylphenyl)-3-oxidothiadiazol-3-ium Traditional Name: 5-(4-mesylphenyl)-4-(6-methyl-3-pyridyl)-3-oxido-thiadiazol-3-ium Formula: C15H13N3O3S2 MolecularWeight: 347.41202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13N3O3S2/c1-10-3-4-12(9-16-10)14-15(22-17-18(14)19)11-5-7-13(8-6-11)23(2,20)21/h3-9H,1-2H3