Vitas-M small molecule compound

N-(2-{[(2E)-2-{2-[(2-chloro-6-fluorobenzyl)oxy]-3-methoxybenzylidene}hydrazinyl]carbonyl}phenyl)-2-fluorobenzamide

Catalog ID
STL344061
SMILES COc1cccc(c1OCc1c(F)cccc1Cl)/C=N/NC(=O)c1ccccc1NC(=O)c1ccccc1F

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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 C29H22ClF2N3O4 MW 549.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22ClF2N3O4/c1-38-26-15-6-8-18(27(26)39-17-21-22(30)11-7-13-24(21)32)16-33-35-29(37)20-10-3-5-14-25(20)34-28(36)19-9-2-4-12-23(19)31/h2-16H,17H2,1H3,(H,34,36)(H,35,37)/b33-16+
InChIKey
LSIIZHTZMHCKIE-MHDJOFBISA-N
Synonyms
395085-14-0
(E)N(2(2(2((2chloro6fluorobenzyl)oxy)3methoxybenzylidene)hydrazinecarbonyl)phenyl)2fluorobenzamide
395085140
COC1=CC=CC(=C1OCC2=C(C=CC=C2Cl)F)C=NNC(=O)C3=CC=CC=C3NC(=O)C4=CC=CC=C4F
COc1cccc(c1OCc1c(F)cccc1Cl)C=NNC(=O)c1ccccc1NC(=O)c1ccccc1F
InChI=1SC29H22ClF2N3O4c13826156818(27(26)39172122(30)1171324(21)32)16333529(37)2010351425(20)3428(36)199241223(19)31h216H17H21H3(H3436)(H3537)b3316+
MFCD01977667
N((E)(2((2CHLORO6FLUOROPHENYL)METHOXY)3METHOXYPHENYL)METHYLIDENEAMINO)2((2FLUOROBENZOYL)AMINO)BENZAMIDE
N(2(((2E)2(2((2chloro6fluorobenzyl)oxy)3methoxybenzylidene)hydrazinyl)carbonyl)phenyl)2fluorobenzamide
ZINC000002407883
ZINC100371102

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Available files

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