4-chloranyl-5-methyl-N-(1H-perimidin-2-yl)-2-sulfanyl-benzenesulfonamide

Systemtic Name: 4-chloranyl-5-methyl-N-(1H-perimidin-2-yl)-2-sulfanyl-benzenesulfonamide Openeye Name: 4-chloro-5-methyl-N-(1H-perimidin-2-yl)-2-sulfanyl-benzenesulfonamide CAS Name: 4-chloro-2-mercapto-5-methyl-N-(1H-perimidin-2-yl)benzenesulfonamide IUPAC Name: 4-chloro-5-methyl-N-(1H-perimidin-2-yl)-2-sulfanylbenzenesulfonamide Traditional Name: 4-chloro-2-mercapto-5-methyl-N-(1H-perimidin-2-yl)benzenesulfonamide Formula: C18H14ClN3O2S2 MolecularWeight: 403.90566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)S)S(=O)(=O)NC2=NC3=CC=CC4=C3C(=CC=C4)N2

Isomeric SMILES

CC1=CC(=C(C=C1Cl)S)S(=O)(=O)NC2=NC3=CC=CC4=C3C(=CC=C4)N2

InChI

InChI=1S/C18H14ClN3O2S2/c1-10-8-16(15(25)9-12(10)19)26(23,24)22-18-20-13-6-2-4-11-5-3-7-14(21-18)17(11)13/h2-9,25H,1H3,(H2,20,21,22)