N-[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]-3-nitro-benzenesulfonamide Openeye Name: N-[4-(4-chlorophenyl)-5-methyl-thiazol-2-yl]-3-nitro-benzenesulfonamide CAS Name: N-[4-(4-chlorophenyl)-5-methyl-2-thiazolyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]-3-nitrobenzenesulfonamide Traditional Name: N-[4-(4-chlorophenyl)-5-methyl-thiazol-2-yl]-3-nitro-benzenesulfonamide Formula: C16H12ClN3O4S2 MolecularWeight: 409.86718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(N=C(S1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H12ClN3O4S2/c1-10-15(11-5-7-12(17)8-6-11)18-16(25-10)19-26(23,24)14-4-2-3-13(9-14)20(21)22/h2-9H,1H3,(H,18,19)