Vitas-M small molecule compound
N'-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylidene]-2-[(4-nitrobenzyl)sulfanyl]acetohydrazide
Catalog ID
STL113862
SMILES O=C(N/N=C/c1cc2OCOc2cc1Br)CSCc1ccc(cc1)[N+](=O)[O-]
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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 C17H14BrN3O5S MW 452.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14BrN3O5S/c18-14-6-16-15(25-10-26-16)5-12(14)7-19-20-17(22)9-27-8-11-1-3-13(4-2-11)21(23)24/h1-7H,8-10H2,(H,20,22)/b19-7+InChIKey
IZLAGEDXGNCBIG-FBCYGCLPSA-NSynonyms
C1OC2=C(O1)C=C(C(=C2)C=NNC(=O)CSCC3=CC=C(C=C3)(N+)(=O)(O))Br
InChI=1SC17H14BrN3O5Sc181461615(25102616)512(14)7192017(22)9278111313(4211)21(23)24h17H810H2(H2022)b197+
MFCD01023574
N((1E)2(6BROMO(2HBENZO(D)13DIOXOLAN5YL))1AZAVINYL)2((4NITROPHENYL)METHYLTHIO)ACETAMIDE
N((E)(6bromo13benzodioxol5yl)methylidene)2((4nitrobenzyl)sulfanyl)acetohydrazide
N((E)(6bromo13benzodioxol5yl)methylideneamino)2((4nitrophenyl)methylsulfanyl)acetamide
O=C(NN=Cc1cc2OCOc2cc1Br)CSCc1ccc(cc1)(N+)(=O)(O)
ZINC000016401843
ZINC103143495
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