Vitas-M small molecule compound

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

Catalog ID
STK105097
SMILES CCn1c(SCC(=O)N/N=C\c2ccccc2OCC(=O)O)nnc1c1ccc(cc1)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 C22H23N5O4S MW 453.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O4S/c1-3-27-21(16-10-8-15(2)9-11-16)25-26-22(27)32-14-19(28)24-23-12-17-6-4-5-7-18(17)31-13-20(29)30/h4-12H,3,13-14H2,1-2H3,(H,24,28)(H,29,30)/b23-12-
InChIKey
IZLXFGCJQFSTJW-FMCGGJTJSA-N
Synonyms

(2((Z)(2(((4ETHYL5(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)PHENOXY)ACETICACID
(E)2(2((2(2((4ethyl5(ptolyl)4H124triazol3yl)thio)acetyl)hydrazono)methyl)phenoxy)aceticacid
2(2((1Z)2(2(4ETHYL5(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETYLAMINO)2AZAVINYL)PHENOXY)ACETICACID
2(2((Z)((2((4ETHYL5(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)PHENOXY)ACETICACID
CCN1C(=NN=C1SCC(=O)NN=CC2=CC=CC=C2OCC(=O)O)C3=CC=C(C=C3)C
CCn1c(SCC(=O)NN=Cc2ccccc2OCC(=O)O)nnc1c1ccc(cc1)C
InChI=1SC22H23N5O4Sc132721(1610815(2)91116)252622(27)321419(28)24231217645718(17)311320(29)30h412H31314H212H3(H2428)(H2930)b2312
MFCD03219611
ZINC000012464839
ZINC8913922

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Available files

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