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

Systemtic Name: N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-3-nitro-benzenesulfonamide Openeye Name: N-[2-(2-methylthiazol-4-yl)ethyl]-3-nitro-benzenesulfonamide CAS Name: N-[2-(2-methyl-4-thiazolyl)ethyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-3-nitrobenzenesulfonamide Traditional Name: N-[2-(2-methylthiazol-4-yl)ethyl]-3-nitro-benzenesulfonamide Formula: C12H13N3O4S2 MolecularWeight: 327.37932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CCNS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CS1)CCNS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O4S2/c1-9-14-10(8-20-9)5-6-13-21(18,19)12-4-2-3-11(7-12)15(16)17/h2-4,7-8,13H,5-6H2,1H3