N-(2-methyl-4-nitro-phenyl)-2-[4-(phenylsulfonylamino)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(2-methyl-4-nitro-phenyl)-2-[4-(phenylsulfonylamino)phenyl]sulfanyl-ethanamide Openeye Name: 2-[4-(benzenesulfonamido)phenyl]sulfanyl-N-(2-methyl-4-nitro-phenyl)acetamide CAS Name: 2-[[4-(benzenesulfonamido)phenyl]thio]-N-(2-methyl-4-nitrophenyl)acetamide IUPAC Name: 2-[4-(benzenesulfonamido)phenyl]sulfanyl-N-(2-methyl-4-nitrophenyl)acetamide Traditional Name: 2-[[4-(benzenesulfonamido)phenyl]thio]-N-(2-methyl-4-nitro-phenyl)acetamide Formula: C21H19N3O5S2 MolecularWeight: 457.52266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H19N3O5S2/c1-15-13-17(24(26)27)9-12-20(15)22-21(25)14-30-18-10-7-16(8-11-18)23-31(28,29)19-5-3-2-4-6-19/h2-13,23H,14H2,1H3,(H,22,25)