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

Systemtic Name: N-[[3-[[5-(2-methylphenyl)carbonyl-1,3-thiazol-2-yl]amino]phenyl]methyl]-3-nitro-benzenesulfonamide Openeye Name: N-[[3-[[5-(2-methylbenzoyl)thiazol-2-yl]amino]phenyl]methyl]-3-nitro-benzenesulfonamide CAS Name: N-[[3-[[5-[(2-methylphenyl)-oxomethyl]-2-thiazolyl]amino]phenyl]methyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[[3-[[5-(2-methylbenzoyl)-1,3-thiazol-2-yl]amino]phenyl]methyl]-3-nitrobenzenesulfonamide Traditional Name: 3-nitro-N-[3-[(5-o-toluoylthiazol-2-yl)amino]benzyl]benzenesulfonamide Formula: C24H20N4O5S2 MolecularWeight: 508.5694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H20N4O5S2/c1-16-6-2-3-11-21(16)23(29)22-15-25-24(34-22)27-18-8-4-7-17(12-18)14-26-35(32,33)20-10-5-9-19(13-20)28(30)31/h2-13,15,26H,14H2,1H3,(H,25,27)