3-chloranyl-4-methyl-N-(4-methylsulfanylphenyl)-5-nitro-benzenesulfonamide

Systemtic Name: 3-chloranyl-4-methyl-N-(4-methylsulfanylphenyl)-5-nitro-benzenesulfonamide Openeye Name: 3-chloro-4-methyl-N-(4-methylsulfanylphenyl)-5-nitro-benzenesulfonamide CAS Name: 3-chloro-4-methyl-N-[4-(methylthio)phenyl]-5-nitrobenzenesulfonamide IUPAC Name: 3-chloro-4-methyl-N-(4-methylsulfanylphenyl)-5-nitrobenzenesulfonamide Traditional Name: 3-chloro-4-methyl-N-[4-(methylthio)phenyl]-5-nitro-benzenesulfonamide Formula: C14H13ClN2O4S2 MolecularWeight: 372.84702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)SC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)SC)Cl

InChI

InChI=1S/C14H13ClN2O4S2/c1-9-13(15)7-12(8-14(9)17(18)19)23(20,21)16-10-3-5-11(22-2)6-4-10/h3-8,16H,1-2H3