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

Systemtic Name: 3-nitro-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzenesulfonamide Openeye Name: N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzenesulfonamide CAS Name: 3-nitro-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzenesulfonamide IUPAC Name: 3-nitro-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzenesulfonamide Traditional Name: N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzenesulfonamide Formula: C11H12N4O4S2 MolecularWeight: 328.36738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(S1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=NN=C(S1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H12N4O4S2/c1-7(2)10-12-13-11(20-10)14-21(18,19)9-5-3-4-8(6-9)15(16)17/h3-7H,1-2H3,(H,13,14)