Vitas-M small molecule compound
N'-{(E)-[3-bromo-4-(butan-2-yloxy)phenyl]methylidene}-5-nitro-1-benzofuran-2-carbohydrazide
Catalog ID
STK192303
SMILES CCC(Oc1ccc(cc1Br)/C=N/NC(=O)c1cc2c(o1)ccc(c2)[N+](=O)[O-])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 C20H18BrN3O5 MW 460.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrN3O5/c1-3-12(2)28-18-6-4-13(8-16(18)21)11-22-23-20(25)19-10-14-9-15(24(26)27)5-7-17(14)29-19/h4-12H,3H2,1-2H3,(H,23,25)/b22-11+InChIKey
GQRHEYOCWVEFEJ-SSDVNMTOSA-NSynonyms
CCC(C)OC1=C(C=C(C=C1)C=NNC(=O)C2=CC3=C(O2)C=CC(=C3)(N+)(=O)(O))Br
CCC(Oc1ccc(cc1Br)C=NNC(=O)c1cc2c(o1)ccc(c2)(N+)(=O)(O))C
InChI=1SC20H18BrN3O5c1312(2)28186413(816(18)21)11222320(25)191014915(24(26)27)5717(14)2919h412H3H212H3(H2325)b2211+
MFCD03762723
N((E)(3BROMO4(BUTAN2YLOXY)PHENYL)METHYLIDENE)5NITRO1BENZOFURAN2CARBOHYDRAZIDE
N((E)(3bromo4butan2yloxyphenyl)methylideneamino)5nitro1benzofuran2carboxamide
ZINC000001095149
ZINC000001095151
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