Vitas-M small molecule compound
{2-[(E)-(2-{[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}hydrazinylidene)methyl]phenoxy}acetic acid
Catalog ID
STL362494
SMILES CCn1c(SCC(=O)N/N=C/c2ccccc2OCC(=O)O)nnc1c1ccccc1
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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 C21H21N5O4S MW 439.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O4S/c1-2-26-20(15-8-4-3-5-9-15)24-25-21(26)31-14-18(27)23-22-12-16-10-6-7-11-17(16)30-13-19(28)29/h3-12H,2,13-14H2,1H3,(H,23,27)(H,28,29)/b22-12+InChIKey
SOQAQDDTUAJQCH-WSDLNYQXSA-NSynonyms
361165-54-0(2((E)(2(((4ethyl5phenyl4H124triazol3yl)sulfanyl)acetyl)hydrazinylidene)methyl)phenoxy)aceticacid
(E)2(2((2(2((4ethyl5phenyl4H124triazol3yl)thio)acetyl)hydrazono)methyl)phenoxy)aceticacid
2(2((E)((2((4ethyl5phenyl124triazol3yl)sulfanyl)acetyl)hydrazinylidene)methyl)phenoxy)aceticacid
361165540
CCN1C(=NN=C1SCC(=O)NN=CC2=CC=CC=C2OCC(=O)O)C3=CC=CC=C3
CCn1c(SCC(=O)NN=Cc2ccccc2OCC(=O)O)nnc1c1ccccc1
InChI=1SC21H21N5O4Sc122620(158435915)242521(26)311418(27)2322121610671117(16)301319(28)29h312H21314H21H3(H2327)(H2829)b2212+
MFCD02224468
ZINC000000863918
ZINC15990437
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