Vitas-M small molecule compound
N'-[(3E)-5-bromo-2-oxo-1-{[2-(pyridin-3-yl)piperidin-1-yl]methyl}-1,2-dihydro-3H-indol-3-ylidene]-2-({[(E)-(3,4-dimethoxyphenyl)methylidene]amino}oxy)acetohydrazide
Catalog ID
STK529308
SMILES COc1cc(/C=N/OCC(=O)N/N=C/2\c3cc(Br)ccc3N(C2=O)CN2CCCCC2c2cccnc2)ccc1OC
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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 C30H31BrN6O5 MW 635.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31BrN6O5/c1-40-26-11-8-20(14-27(26)41-2)16-33-42-18-28(38)34-35-29-23-15-22(31)9-10-25(23)37(30(29)39)19-36-13-4-3-7-24(36)21-6-5-12-32-17-21/h5-6,8-12,14-17,24H,3-4,7,13,18-19H2,1-2H3,(H,34,38)/b33-16+,35-29+InChIKey
SNRKKOPTOSPYOI-PEFPZMEOSA-NSynonyms
(E)N(5bromo2oxo1((2(pyridin3yl)piperidin1yl)methyl)indolin3ylidene)2(((E)(34dimethoxybenzylidene)amino)oxy)acetohydrazide
COC1=C(C=C(C=C1)C=NOCC(=O)NN=C2C3=C(C=CC(=C3)Br)N(C2=O)CN4CCCCC4C5=CN=CC=C5)OC
COc1cc(C=NOCC(=O)NN=C2c3cc(Br)ccc3N(C2=O)CN2CCCCC2c2cccnc2)ccc1OC
InChI=1SC30H31BrN6O5c1402611820(1427(26)412)1633421828(38)343529231522(31)91025(23)37(30(29)39)19361343724(36)216512321721h56812141724H347131819H212H3(H3438)b3316+3529+
MFCD01879555
N((3E)5bromo2oxo1((2(pyridin3yl)piperidin1yl)methyl)12dihydro3Hindol3ylidene)2((((E)(34dimethoxyphenyl)methylidene)amino)oxy)acetohydrazide
N((E)(5bromo2oxo1((2pyridin3ylpiperidin1yl)methyl)indol3ylidene)amino)2((E)(34dimethoxyphenyl)methylideneamino)oxyacetamide
ZINC000097966349
ZINC000097966350
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