N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-5-nitro-thiophene-2-carboxamide

Systemtic Name: N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-5-nitro-thiophene-2-carboxamide Openeye Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-5-nitro-thiophene-2-carboxamide CAS Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-5-nitro-2-thiophenecarboxamide IUPAC Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-5-nitrothiophene-2-carboxamide Traditional Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-5-nitro-thiophene-2-carboxamide Formula: C12H5F2N3O3S2 MolecularWeight: 341.313206

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)[N+](=O)[O-])C(=O)NC2=NC3=C(C=C(C=C3S2)F)F

Isomeric SMILES

C1=C(SC(=C1)[N+](=O)[O-])C(=O)NC2=NC3=C(C=C(C=C3S2)F)F

InChI

InChI=1S/C12H5F2N3O3S2/c13-5-3-6(14)10-8(4-5)22-12(15-10)16-11(18)7-1-2-9(21-7)17(19)20/h1-4H,(H,15,16,18)