N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-4-chloranyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-4-chloranyl-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-3-nitro-benzenesulfonamide Formula: C13H6ClF2N3O4S2 MolecularWeight: 405.784246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)NC2=NC3=C(C=C(C=C3S2)F)F)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)NC2=NC3=C(C=C(C=C3S2)F)F)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H6ClF2N3O4S2/c14-8-2-1-7(5-10(8)19(20)21)25(22,23)18-13-17-12-9(16)3-6(15)4-11(12)24-13/h1-5H,(H,17,18)