2-nitro-3-[1-(2H-1,2,3-thiadiazol-3-ylamino)hexyl]benzenesulfonamide

Systemtic Name: 2-nitro-3-[1-(2H-1,2,3-thiadiazol-3-ylamino)hexyl]benzenesulfonamide Openeye Name: 2-nitro-3-[1-(2H-thiadiazol-3-ylamino)hexyl]benzenesulfonamide CAS Name: 2-nitro-3-[1-(2H-thiadiazol-3-ylamino)hexyl]benzenesulfonamide IUPAC Name: 2-nitro-3-[1-(2H-thiadiazol-3-ylamino)hexyl]benzenesulfonamide Traditional Name: 2-nitro-3-[1-(2H-thiadiazol-3-ylamino)hexyl]benzenesulfonamide Formula: C14H21N5O4S2 MolecularWeight: 387.47764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=C(C(=CC=C1)S(=O)(=O)N)[N+](=O)[O-])NN2C=CSN2

Isomeric SMILES

CCCCCC(C1=C(C(=CC=C1)S(=O)(=O)N)[N+](=O)[O-])NN2C=CSN2

InChI

InChI=1S/C14H21N5O4S2/c1-2-3-4-7-12(16-18-9-10-24-17-18)11-6-5-8-13(25(15,22)23)14(11)19(20)21/h5-6,8-10,12,16-17H,2-4,7H2,1H3,(H2,15,22,23)