N-(5-butyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzenesulfonamide

Systemtic Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzenesulfonamide Openeye Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzenesulfonamide CAS Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-3-nitrobenzenesulfonamide IUPAC Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-3-nitrobenzenesulfonamide Traditional Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzenesulfonamide Formula: C12H14N4O4S2 MolecularWeight: 342.39396

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(S1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=NN=C(S1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O4S2/c1-2-3-7-11-13-14-12(21-11)15-22(19,20)10-6-4-5-9(8-10)16(17)18/h4-6,8H,2-3,7H2,1H3,(H,14,15)