4-chloranyl-5-methyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-2-sulfanyl-benzenesulfonamide

Systemtic Name: 4-chloranyl-5-methyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-2-sulfanyl-benzenesulfonamide Openeye Name: 4-chloro-5-methyl-N-[5-(2-pyridyl)-1H-1,2,4-triazol-3-yl]-2-sulfanyl-benzenesulfonamide CAS Name: 4-chloro-2-mercapto-5-methyl-N-[5-(2-pyridinyl)-1H-1,2,4-triazol-3-yl]benzenesulfonamide IUPAC Name: 4-chloro-5-methyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-2-sulfanylbenzenesulfonamide Traditional Name: 4-chloro-2-mercapto-5-methyl-N-[5-(2-pyridyl)-1H-1,2,4-triazol-3-yl]benzenesulfonamide Formula: C14H12ClN5O2S2 MolecularWeight: 381.86038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)S)S(=O)(=O)NC2=NNC(=N2)C3=CC=CC=N3

Isomeric SMILES

CC1=CC(=C(C=C1Cl)S)S(=O)(=O)NC2=NNC(=N2)C3=CC=CC=N3

InChI

InChI=1S/C14H12ClN5O2S2/c1-8-6-12(11(23)7-9(8)15)24(21,22)20-14-17-13(18-19-14)10-4-2-3-5-16-10/h2-7,23H,1H3,(H2,17,18,19,20)