Vitas-M small molecule compound
2-(2,4-difluorophenoxy)-N'-[(E)-{4-ethoxy-3-[(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)methyl]phenyl}methylidene]acetohydrazide
Catalog ID
STK676596
SMILES CCOc1ccc(cc1CN1CC2CC(C1)c1n(C2)c(=O)ccc1)/C=N/NC(=O)COc1ccc(cc1F)F
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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 C29H30F2N4O4 MW 536.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30F2N4O4/c1-2-38-26-8-6-19(13-32-33-28(36)18-39-27-9-7-23(30)12-24(27)31)10-22(26)17-34-14-20-11-21(16-34)25-4-3-5-29(37)35(25)15-20/h3-10,12-13,20-21H,2,11,14-18H2,1H3,(H,33,36)/b32-13+InChIKey
ZYGAMJIRHCMDGE-JJKQSNDFSA-NSynonyms
2(24difluorophenoxy)N((E)(4ethoxy3((8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)methyl)phenyl)methylidene)acetohydrazide
CCOC1=C(C=C(C=C1)C=NNC(=O)COC2=C(C=C(C=C2)F)F)CN3CC4CC(C3)C5=CC=CC(=O)N5C4
CCOc1ccc(cc1CN1CC2CC(C1)c1n(C2)c(=O)ccc1)C=NNC(=O)COc1ccc(cc1F)F
InChI=1SC29H30F2N4O4c1238268619(13323328(36)1839279723(30)1224(27)31)1022(26)173414201121(1634)2543529(37)35(25)1520h31012132021H2111418H21H3(H3336)b3213+
MFCD02139852
ZINC000001026735
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