Vitas-M small molecule compound
N'-[(E)-{3-[(5-fluoro-2-nitrophenoxy)methyl]-4-methoxyphenyl}methylidene]-3-methylthiophene-2-carbohydrazide
Catalog ID
STK452677
SMILES COc1ccc(cc1COc1cc(F)ccc1[N+](=O)[O-])/C=N/NC(=O)c1sccc1C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H18FN3O5S MW 443.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18FN3O5S/c1-13-7-8-31-20(13)21(26)24-23-11-14-3-6-18(29-2)15(9-14)12-30-19-10-16(22)4-5-17(19)25(27)28/h3-11H,12H2,1-2H3,(H,24,26)/b23-11+InChIKey
BVOIMAHSQUHQTL-FOKLQQMPSA-NSynonyms
CC1=C(SC=C1)C(=O)NN=CC2=CC(=C(C=C2)OC)COC3=C(C=CC(=C3)F)(N+)(=O)(O)
COc1ccc(cc1COc1cc(F)ccc1(N+)(=O)(O))C=NNC(=O)c1sccc1C
InChI=1SC21H18FN3O5Sc113783120(13)21(26)242311143618(292)15(914)1230191016(22)4517(19)25(27)28h311H12H212H3(H2426)b2311+
MFCD02607201
N((1E)2(3((5FLUORO2NITROPHENOXY)METHYL)4METHOXYPHENYL)1AZAVINYL)(3METHYL(2THIENYL))CARBOXAMIDE
N((E)(3((5fluoro2nitrophenoxy)methyl)4methoxyphenyl)methylidene)3methylthiophene2carbohydrazide
N((E)(3((5fluoro2nitrophenoxy)methyl)4methoxyphenyl)methylideneamino)3methylthiophene2carboxamide
ZINC000002762868
ZINC98039632
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