Vitas-M small molecule compound

(2-{(E)-[2-({[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenoxy)acetic acid

Catalog ID
STL362596
SMILES COc1ccc(cc1)c1nnc(n1CC)SCC(=O)N/N=C/c1ccccc1OCC(=O)O

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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 C22H23N5O5S MW 469.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O5S/c1-3-27-21(15-8-10-17(31-2)11-9-15)25-26-22(27)33-14-19(28)24-23-12-16-6-4-5-7-18(16)32-13-20(29)30/h4-12H,3,13-14H2,1-2H3,(H,24,28)(H,29,30)/b23-12+
InChIKey
NWEUIWXQYCJPKC-FSJBWODESA-N
Synonyms
329910-93-2
(2((E)(2(((4ethyl5(4methoxyphenyl)4H124triazol3yl)sulfanyl)acetyl)hydrazinylidene)methyl)phenoxy)aceticacid
(E)2(2((2(2((4ethyl5(4methoxyphenyl)4H124triazol3yl)thio)acetyl)hydrazono)methyl)phenoxy)aceticacid
2(2((1E)2(2(4ETHYL5(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETYLAMINO)2AZAVINYL)PHENOXY)ACETICACID
2(2((E)((2((4ETHYL5(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)PHENOXY)ACETICACID
329910932
CCN1C(=NN=C1SCC(=O)NN=CC2=CC=CC=C2OCC(=O)O)C3=CC=C(C=C3)OC
COc1ccc(cc1)c1nnc(n1CC)SCC(=O)NN=Cc1ccccc1OCC(=O)O
InChI=1SC22H23N5O5Sc132721(1581017(312)11915)252622(27)331419(28)24231216645718(16)321320(29)30h412H31314H212H3(H2428)(H2930)b2312+
MFCD02224525
ZINC000009057249
ZINC15979617

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.