Vitas-M small molecule compound

N'-{(3Z)-5-bromo-2-oxo-1-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)methyl]-1,2-dihydro-3H-indol-3-ylidene}-2-(4-methoxyphenoxy)acetohydrazide

Catalog ID
STK725611
SMILES COc1ccc(cc1)OCC(=O)N/N=C\1/c2cc(Br)ccc2N(C1=O)CN1CC2(CC1CC(C2)(C)C)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 C28H33BrN4O4 MW 569.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33BrN4O4/c1-27(2)12-19-13-28(3,15-27)16-32(19)17-33-23-10-5-18(29)11-22(23)25(26(33)35)31-30-24(34)14-37-21-8-6-20(36-4)7-9-21/h5-11,19H,12-17H2,1-4H3,(H,30,34)/b31-25-
InChIKey
GXYFGSVDVSRIFA-GDWJVWIDSA-N
Synonyms
627054-63-1
(Z)N(5bromo2oxo1(((1S5R)133trimethyl6azabicyclo(321)octan6yl)methyl)indolin3ylidene)2(4methoxyphenoxy)acetohydrazide
627054631
CC1(CC2CC(C1)(CN2CN3C4=C(C=C(C=C4)Br)C(=NNC(=O)COC5=CC=C(C=C5)OC)C3=O)C)C
COc1ccc(cc1)OCC(=O)NN=C1c2cc(Br)ccc2N(C1=O)CN1C(C@@)2(C(C@H)1CC(C2)(C)C)C
COc1ccc(cc1)OCC(=O)NN=C1c2cc(Br)ccc2N(C1=O)CN1CC2(CC1CC(C2)(C)C)C
InChI=1SC28H33BrN4O4c127(2)12191328(31527)1632(19)17332310518(29)1122(23)25(26(33)35)313024(34)1437218620(364)7921h51119H1217H214H3(H3034)b3125
MFCD04109130
N((3Z)5bromo2oxo1((133trimethyl6azabicyclo(321)oct6yl)methyl)12dihydro3Hindol3ylidene)2(4methoxyphenoxy)acetohydrazide
N((Z)(5BROMO2OXO1((335TRIMETHYL7AZABICYCLO(321)OCTAN7YL)METHYL)INDOL3YLIDENE)AMINO)2(4METHOXYPHENOXY)ACETAMIDE
ZINC000102647488

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Available files

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