N-[3-[[5-(2-methylphenyl)carbonyl-1,3-thiazol-2-yl]amino]phenyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[3-[[5-(2-methylphenyl)carbonyl-1,3-thiazol-2-yl]amino]phenyl]-3-nitro-benzenesulfonamide Openeye Name: N-[3-[[5-(2-methylbenzoyl)thiazol-2-yl]amino]phenyl]-3-nitro-benzenesulfonamide CAS Name: N-[3-[[5-[(2-methylphenyl)-oxomethyl]-2-thiazolyl]amino]phenyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[3-[[5-(2-methylbenzoyl)-1,3-thiazol-2-yl]amino]phenyl]-3-nitrobenzenesulfonamide Traditional Name: 3-nitro-N-[3-[(5-o-toluoylthiazol-2-yl)amino]phenyl]benzenesulfonamide Formula: C23H18N4O5S2 MolecularWeight: 494.54282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C2=CN=C(S2)NC3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C(=O)C2=CN=C(S2)NC3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H18N4O5S2/c1-15-6-2-3-11-20(15)22(28)21-14-24-23(33-21)25-16-7-4-8-17(12-16)26-34(31,32)19-10-5-9-18(13-19)27(29)30/h2-14,26H,1H3,(H,24,25)