N-[6-[bis(fluoranyl)methoxy]-1,3-benzothiazol-2-yl]-1-methyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[6-[bis(fluoranyl)methoxy]-1,3-benzothiazol-2-yl]-1-methyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[6-(difluoromethoxy)-1,3-benzothiazol-2-yl]-1-methyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[6-(difluoromethoxy)-1,3-benzothiazol-2-yl]-1-methyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[6-(difluoromethoxy)-1,3-benzothiazol-2-yl]-1-methyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[6-(difluoromethoxy)-1,3-benzothiazol-2-yl]-1-methyl-4-nitro-pyrazole-3-carboxamide Formula: C13H9F2N5O4S MolecularWeight: 369.303466

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NC2=NC3=C(S2)C=C(C=C3)OC(F)F)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NC2=NC3=C(S2)C=C(C=C3)OC(F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H9F2N5O4S/c1-19-5-8(20(22)23)10(18-19)11(21)17-13-16-7-3-2-6(24-12(14)15)4-9(7)25-13/h2-5,12H,1H3,(H,16,17,21)