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-({[(1E)-1-(thiophen-2-yl)ethylidene]amino}oxy)acetohydrazide

Catalog ID
STK006684
SMILES O=C(N/N=C\1/c2cc(Br)ccc2N(C1=O)CN1CC2(CC1CC(C2)(C)C)C)CO/N=C(/c1cccs1)\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 C27H32BrN5O3S MW 586.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32BrN5O3S/c1-17(22-6-5-9-37-22)31-36-13-23(34)29-30-24-20-10-18(28)7-8-21(20)33(25(24)35)16-32-15-27(4)12-19(32)11-26(2,3)14-27/h5-10,19H,11-16H2,1-4H3,(H,29,34)/b30-24-,31-17+
InChIKey
CJRWDLCRXVZHDF-CURMTFMFSA-N
Synonyms
627054-86-8
627054868
CC(=NOCC(=O)NN=C1C2=C(C=CC(=C2)Br)N(C1=O)CN3CC4(CC3CC(C4)(C)C)C)C5=CC=CS5
InChI=1SC27H32BrN5O3Sc117(226593722)31361323(34)293024201018(28)7821(20)33(25(24)35)16321527(4)1219(32)1126(23)1427h51019H1116H214H3(H2934)b30243117+
MFCD04109143
N((3Z)5BROMO2OXO1((133TRIMETHYL6AZABICYCLO(321)OCT6YL)METHYL)12DIHYDRO3HINDOL3YLIDENE)2((((1E)1(THIOPHEN2YL)ETHYLIDENE)AMINO)OXY)ACETOHYDRAZIDE
N((Z)(5bromo2oxo1((335trimethyl7azabicyclo(321)octan7yl)methyl)indol3ylidene)amino)2((E)1thiophen2ylethylideneamino)oxyacetamide
O=C(NN=C1c2cc(Br)ccc2N(C1=O)CN1CC2(CC1CC(C2)(C)C)C)CON=C(c1cccs1)C
STK006684
ZINC000245225973

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Available files

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