Vitas-M small molecule compound
N'-[(E)-(4-bromophenyl)methylidene]-5-(4,6-dibromo-7-methoxy-1,3-benzodioxol-5-yl)-4-methyl-4,5-dihydro-1,2-oxazole-3-carbohydrazide
Catalog ID
STK693129
SMILES COc1c(Br)c(C2ON=C(C2C)C(=O)N/N=C/c2ccc(cc2)Br)c(c2c1OCO2)Br
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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 C20H16Br3N3O5 MW 618.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16Br3N3O5/c1-9-15(20(27)25-24-7-10-3-5-11(21)6-4-10)26-31-16(9)12-13(22)17(28-2)19-18(14(12)23)29-8-30-19/h3-7,9,16H,8H2,1-2H3,(H,25,27)/b24-7+InChIKey
CXZJCVQCXRNTSD-HCBMXOAHSA-NSynonyms
CC1C(ON=C1C(=O)NN=CC2=CC=C(C=C2)Br)C3=C(C4=C(C(=C3Br)OC)OCO4)Br
COc1c(Br)c(C2ON=C(C2C)C(=O)NN=Cc2ccc(cc2)Br)c(c2c1OCO2)Br
InChI=1SC20H16Br3N3O5c1915(20(27)25247103511(21)6410)263116(9)1213(22)17(282)1918(14(12)23)2983019h37916H8H212H3(H2527)b247+
MFCD10039208
N((E)(4bromophenyl)methylidene)5(46dibromo7methoxy13benzodioxol5yl)4methyl45dihydro12oxazole3carbohydrazide
N((E)(4bromophenyl)methylideneamino)5(46dibromo7methoxy13benzodioxol5yl)4methyl45dihydro12oxazole3carboxamide
ZINC000150402089
ZINC000150402105
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