Vitas-M small molecule compound
N'-[(E)-{4-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-3-methoxyphenyl}methylidene]-3-chlorobenzohydrazide
Catalog ID
STK452150
SMILES COc1cc(/C=N/NC(=O)c2cccc(c2)Cl)ccc1Cn1nc(c(c1C)Br)C
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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 C21H20BrClN4O2 MW 475.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20BrClN4O2/c1-13-20(22)14(2)27(26-13)12-17-8-7-15(9-19(17)29-3)11-24-25-21(28)16-5-4-6-18(23)10-16/h4-11H,12H2,1-3H3,(H,25,28)/b24-11+InChIKey
ZRSFLTWKRYKOIW-BHGWPJFGSA-NSynonyms
CC1=C(C(=NN1CC2=C(C=C(C=C2)C=NNC(=O)C3=CC(=CC=C3)Cl)OC)C)Br
COc1cc(C=NNC(=O)c2cccc(c2)Cl)ccc1Cn1nc(c(c1C)Br)C
InChI=1SC21H20BrClN4O2c11320(22)14(2)27(2613)12178715(919(17)293)11242521(28)1654618(23)1016h411H12H213H3(H2528)b2411+
MFCD03072385
N((1E)2(4((4BROMO35DIMETHYLPYRAZOLYL)METHYL)3METHOXYPHENYL)1AZAVINYL)(3CHLOROPHENYL)CARBOXAMIDE
N((E)(4((4bromo35dimethyl1Hpyrazol1yl)methyl)3methoxyphenyl)methylidene)3chlorobenzohydrazide
N((E)(4((4BROMO35DIMETHYLPYRAZOL1YL)METHYL)3METHOXYPHENYL)METHYLIDENEAMINO)3CHLOROBENZAMIDE
N(4((4BROMO35DIMETHYL1HPYRAZOL1YL)METHYL)3METHOXYBENZYLIDENE)3CHLOROBENZOHYDRAZIDE
ZINC000000676245
ZINC33334099
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