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

Systemtic Name: N-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]-4-nitro-benzenesulfonamide Openeye Name: N-[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]-4-nitro-benzenesulfonamide CAS Name: N-[4-(4-bromophenyl)-5-methyl-2-thiazolyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]-4-nitrobenzenesulfonamide Traditional Name: N-[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]-4-nitro-benzenesulfonamide Formula: C16H12BrN3O4S2 MolecularWeight: 454.31818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12BrN3O4S2/c1-10-15(11-2-4-12(17)5-3-11)18-16(25-10)19-26(23,24)14-8-6-13(7-9-14)20(21)22/h2-9H,1H3,(H,18,19)