N-(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)-2-nitro-benzenesulfonamide

Systemtic Name: N-(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)-2-nitro-benzenesulfonamide Openeye Name: N-(5-acetyl-4-methyl-thiazol-2-yl)-2-nitro-benzenesulfonamide CAS Name: N-(5-acetyl-4-methyl-2-thiazolyl)-2-nitrobenzenesulfonamide IUPAC Name: N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-nitrobenzenesulfonamide Traditional Name: N-(5-acetyl-4-methyl-thiazol-2-yl)-2-nitro-benzenesulfonamide Formula: C12H11N3O5S2 MolecularWeight: 341.36284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11N3O5S2/c1-7-11(8(2)16)21-12(13-7)14-22(19,20)10-6-4-3-5-9(10)15(17)18/h3-6H,1-2H3,(H,13,14)