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

Systemtic Name: N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-4-nitro-benzenesulfonamide Openeye Name: N-[2-(2,4-dimethylthiazol-5-yl)ethyl]-4-nitro-benzenesulfonamide CAS Name: N-[2-(2,4-dimethyl-5-thiazolyl)ethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-4-nitrobenzenesulfonamide Traditional Name: N-[2-(2,4-dimethylthiazol-5-yl)ethyl]-4-nitro-benzenesulfonamide Formula: C13H15N3O4S2 MolecularWeight: 341.4059

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C)CCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)C)CCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O4S2/c1-9-13(21-10(2)15-9)7-8-14-22(19,20)12-5-3-11(4-6-12)16(17)18/h3-6,14H,7-8H2,1-2H3