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

Systemtic Name: 4-chloranyl-5-methyl-N-(2-methyl-5-phenylazanyl-1,2,4-triazol-3-yl)-2-sulfanyl-benzenesulfonamide Openeye Name: N-(5-anilino-2-methyl-1,2,4-triazol-3-yl)-4-chloro-5-methyl-2-sulfanyl-benzenesulfonamide CAS Name: N-(5-anilino-2-methyl-1,2,4-triazol-3-yl)-4-chloro-2-mercapto-5-methylbenzenesulfonamide IUPAC Name: N-(5-anilino-2-methyl-1,2,4-triazol-3-yl)-4-chloro-5-methyl-2-sulfanylbenzenesulfonamide Traditional Name: N-(5-anilino-2-methyl-1,2,4-triazol-3-yl)-4-chloro-2-mercapto-5-methyl-benzenesulfonamide Formula: C16H16ClN5O2S2 MolecularWeight: 409.91354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)S)S(=O)(=O)NC2=NC(=NN2C)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1Cl)S)S(=O)(=O)NC2=NC(=NN2C)NC3=CC=CC=C3

InChI

InChI=1S/C16H16ClN5O2S2/c1-10-8-14(13(25)9-12(10)17)26(23,24)21-16-19-15(20-22(16)2)18-11-6-4-3-5-7-11/h3-9,25H,1-2H3,(H2,18,19,20,21)