(5-chloranyl-4-methyl-2-sulfamoyl-phenyl) (1Z)-4-chloranyl-N-[(4-nitrophenyl)amino]benzenecarboximidothioate

Systemtic Name: (5-chloranyl-4-methyl-2-sulfamoyl-phenyl) (1Z)-4-chloranyl-N-[(4-nitrophenyl)amino]benzenecarboximidothioate Openeye Name: (5-chloro-4-methyl-2-sulfamoyl-phenyl) (1Z)-4-chloro-N-(4-nitroanilino)benzenecarboximidothioate CAS Name: (1Z)-4-chloro-N-(4-nitroanilino)benzenecarboximidothioic acid (5-chloro-4-methyl-2-sulfamoylphenyl) ester IUPAC Name: (5-chloro-4-methyl-2-sulfamoylphenyl) (1Z)-4-chloro-N-(4-nitroanilino)benzenecarboximidothioate Traditional Name: (1Z)-4-chloro-N-(4-nitroanilino)benzenecarboximidothioic acid (5-chloro-4-methyl-2-sulfamoyl-phenyl) ester Formula: C20H16Cl2N4O4S2 MolecularWeight: 511.40144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)SC(=NNC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)Cl)S(=O)(=O)N

Isomeric SMILES

CC1=CC(=C(C=C1Cl)S/C(=N\NC2=CC=C(C=C2)[N+](=O)[O-])/C3=CC=C(C=C3)Cl)S(=O)(=O)N

InChI

InChI=1S/C20H16Cl2N4O4S2/c1-12-10-19(32(23,29)30)18(11-17(12)22)31-20(13-2-4-14(21)5-3-13)25-24-15-6-8-16(9-7-15)26(27)28/h2-11,24H,1H3,(H2,23,29,30)/b25-20-