4-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-N-methyl-3-nitro-benzenesulfonamide Formula: C15H17N5O4S2 MolecularWeight: 395.45658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)SC2=NN=C(N2C3CC3)C4CC4)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)SC2=NN=C(N2C3CC3)C4CC4)[N+](=O)[O-]

InChI

InChI=1S/C15H17N5O4S2/c1-16-26(23,24)11-6-7-13(12(8-11)20(21)22)25-15-18-17-14(9-2-3-9)19(15)10-4-5-10/h6-10,16H,2-5H2,1H3