Vitas-M small molecule compound
N'-[(E)-{4-[(4-bromobenzyl)oxy]-3-methoxy-5-(prop-2-en-1-yl)phenyl}methylidene]-4-cyano-2-fluorobenzohydrazide
Catalog ID
STK198113
SMILES C=CCc1cc(/C=N/NC(=O)c2ccc(cc2F)C#N)cc(c1OCc1ccc(cc1)Br)OC
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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 C26H21BrFN3O3 MW 522.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21BrFN3O3/c1-3-4-20-11-19(15-30-31-26(32)22-10-7-18(14-29)12-23(22)28)13-24(33-2)25(20)34-16-17-5-8-21(27)9-6-17/h3,5-13,15H,1,4,16H2,2H3,(H,31,32)/b30-15+InChIKey
ZJSIOFJHOGLRLZ-FJEPWZHXSA-NSynonyms
C=CCc1cc(C=NNC(=O)c2ccc(cc2F)C#N)cc(c1OCc1ccc(cc1)Br)OC
COC1=CC(=CC(=C1OCC2=CC=C(C=C2)Br)CC=C)C=NNC(=O)C3=C(C=C(C=C3)C#N)F
InChI=1SC26H21BrFN3O3c134201119(15303126(32)2210718(1429)1223(22)28)1324(332)25(20)3416175821(27)9617h351315H1416H22H3(H3132)b3015+
MFCD05800842
N((E)(4((4BROMOBENZYL)OXY)3METHOXY5(PROP2EN1YL)PHENYL)METHYLIDENE)4CYANO2FLUOROBENZOHYDRAZIDE
N((E)(4((4bromophenyl)methoxy)3methoxy5prop2enylphenyl)methylideneamino)4cyano2fluorobenzamide
ZINC000097960857
ZINC101749084
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