3-nitro-4-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)benzenesulfonamide

Systemtic Name: 3-nitro-4-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)benzenesulfonamide Openeye Name: 3-nitro-4-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)benzenesulfonamide CAS Name: 3-nitro-4-([1,2,4]triazolo[4,3-a]pyridin-3-ylthio)benzenesulfonamide IUPAC Name: 3-nitro-4-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)benzenesulfonamide Traditional Name: 3-nitro-4-([1,2,4]triazolo[4,3-a]pyridin-3-ylthio)benzenesulfonamide Formula: C12H9N5O4S2 MolecularWeight: 351.36096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NN=C(N2C=C1)SC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=NN=C(N2C=C1)SC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C12H9N5O4S2/c13-23(20,21)8-4-5-10(9(7-8)17(18)19)22-12-15-14-11-3-1-2-6-16(11)12/h1-7H,(H2,13,20,21)