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

Systemtic Name: N-[6-[bis(fluoranyl)methoxy]-1,3-benzothiazol-2-yl]-4-bromanyl-2-methyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-[6-(difluoromethoxy)-1,3-benzothiazol-2-yl]-2-methyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-[6-(difluoromethoxy)-1,3-benzothiazol-2-yl]-2-methyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-[6-(difluoromethoxy)-1,3-benzothiazol-2-yl]-2-methylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-[6-(difluoromethoxy)-1,3-benzothiazol-2-yl]-2-methyl-pyrazole-3-carboxamide Formula: C13H9BrF2N4O2S MolecularWeight: 403.201966

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Br)C(=O)NC2=NC3=C(S2)C=C(C=C3)OC(F)F

Isomeric SMILES

CN1C(=C(C=N1)Br)C(=O)NC2=NC3=C(S2)C=C(C=C3)OC(F)F

InChI

InChI=1S/C13H9BrF2N4O2S/c1-20-10(7(14)5-17-20)11(21)19-13-18-8-3-2-6(22-12(15)16)4-9(8)23-13/h2-5,12H,1H3,(H,18,19,21)