4-(2,4-dimethylphenyl)sulfanyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-(2,4-dimethylphenyl)sulfanyl-3-nitro-benzenesulfonamide Openeye Name: 4-(2,4-dimethylphenyl)sulfanyl-3-nitro-benzenesulfonamide CAS Name: 4-[(2,4-dimethylphenyl)thio]-3-nitrobenzenesulfonamide IUPAC Name: 4-(2,4-dimethylphenyl)sulfanyl-3-nitrobenzenesulfonamide Traditional Name: 4-[(2,4-dimethylphenyl)thio]-3-nitro-benzenesulfonamide Formula: C14H14N2O4S2 MolecularWeight: 338.40196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)SC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])C

InChI

InChI=1S/C14H14N2O4S2/c1-9-3-5-13(10(2)7-9)21-14-6-4-11(22(15,19)20)8-12(14)16(17)18/h3-8H,1-2H3,(H2,15,19,20)