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

Systemtic Name: 4-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-ethyl-3-nitro-N-phenyl-benzenesulfonamide Openeye Name: 4-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-ethyl-3-nitro-N-phenyl-benzenesulfonamide CAS Name: 4-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-N-ethyl-3-nitro-N-phenylbenzenesulfonamide IUPAC Name: 4-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-ethyl-3-nitro-N-phenylbenzenesulfonamide Traditional Name: 4-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-N-ethyl-3-nitro-N-phenyl-benzenesulfonamide Formula: C22H23N5O4S2 MolecularWeight: 485.57912

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)SC3=NN=C(N3C4CC4)C5CC5)[N+](=O)[O-]

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)SC3=NN=C(N3C4CC4)C5CC5)[N+](=O)[O-]

InChI

InChI=1S/C22H23N5O4S2/c1-2-25(16-6-4-3-5-7-16)33(30,31)18-12-13-20(19(14-18)27(28)29)32-22-24-23-21(15-8-9-15)26(22)17-10-11-17/h3-7,12-15,17H,2,8-11H2,1H3