Vitas-M small molecule compound
dimethyl 2-[({[5-(4,5-dimethylthiophen-3-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzene-1,4-dicarboxylate
Catalog ID
STK473728
SMILES COC(=O)c1ccc(cc1NC(=O)CSc1nnc(n1CC)c1csc(c1C)C)C(=O)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 C22H24N4O5S2 MW 488.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O5S2/c1-6-26-19(16-10-32-13(3)12(16)2)24-25-22(26)33-11-18(27)23-17-9-14(20(28)30-4)7-8-15(17)21(29)31-5/h7-10H,6,11H2,1-5H3,(H,23,27)InChIKey
QWKHXKFUJMRTGW-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC)C3=CSC(=C3C)C
dimethyl2((((5(45dimethylthiophen3yl)4ethyl4H124triazol3yl)sulfanyl)acetyl)amino)benzene14dicarboxylate
dimethyl2((2((5(45dimethylthiophen3yl)4ethyl124triazol3yl)sulfanyl)acetyl)amino)benzene14dicarboxylate
InChI=1SC22H24N4O5S2c162619(16103213(3)12(16)2)242522(26)331118(27)2317914(20(28)304)7815(17)21(29)315h710H611H215H3(H2327)
METHYL3(2(5(45DIMETHYL(3THIENYL))4ETHYL(124TRIAZOL3YLTHIO))ACETYLAMINO)4(METHOXYCARBONYL)BENZOATE
MFCD06046381
ZINC000020214353
ZINC20214353
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