3-nitro-4-(2,3,5,6-tetramethylphenyl)sulfanyl-benzenesulfonamide

Systemtic Name: 3-nitro-4-(2,3,5,6-tetramethylphenyl)sulfanyl-benzenesulfonamide Openeye Name: 3-nitro-4-(2,3,5,6-tetramethylphenyl)sulfanyl-benzenesulfonamide CAS Name: 3-nitro-4-[(2,3,5,6-tetramethylphenyl)thio]benzenesulfonamide IUPAC Name: 3-nitro-4-(2,3,5,6-tetramethylphenyl)sulfanylbenzenesulfonamide Traditional Name: 3-nitro-4-[(2,3,5,6-tetramethylphenyl)thio]benzenesulfonamide Formula: C16H18N2O4S2 MolecularWeight: 366.45512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)SC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)SC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])C)C

InChI

InChI=1S/C16H18N2O4S2/c1-9-7-10(2)12(4)16(11(9)3)23-15-6-5-13(24(17,21)22)8-14(15)18(19)20/h5-8H,1-4H3,(H2,17,21,22)