N-[6-[bis(fluoranyl)methoxy]-1,3-benzothiazol-2-yl]-4-bromanyl-1,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: N-[6-[bis(fluoranyl)methoxy]-1,3-benzothiazol-2-yl]-4-bromanyl-1,5-dimethyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-[6-(difluoromethoxy)-1,3-benzothiazol-2-yl]-1,5-dimethyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-[6-(difluoromethoxy)-1,3-benzothiazol-2-yl]-1,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-[6-(difluoromethoxy)-1,3-benzothiazol-2-yl]-1,5-dimethylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-[6-(difluoromethoxy)-1,3-benzothiazol-2-yl]-1,5-dimethyl-pyrazole-3-carboxamide Formula: C14H11BrF2N4O2S MolecularWeight: 417.228546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C(=O)NC2=NC3=C(S2)C=C(C=C3)OC(F)F)Br

Isomeric SMILES

CC1=C(C(=NN1C)C(=O)NC2=NC3=C(S2)C=C(C=C3)OC(F)F)Br

InChI

InChI=1S/C14H11BrF2N4O2S/c1-6-10(15)11(20-21(6)2)12(22)19-14-18-8-4-3-7(23-13(16)17)5-9(8)24-14/h3-5,13H,1-2H3,(H,18,19,22)