Vitas-M small molecule compound
2-(5-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)-N-(4-methoxyphenyl)acetamide
Catalog ID
STK221691
SMILES COc1ccc(cc1)NC(=O)Cc1nnc(n1CC)SCC(=O)N1CCc2c(C1)cccc2
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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 C24H27N5O3S MW 465.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N5O3S/c1-3-29-21(14-22(30)25-19-8-10-20(32-2)11-9-19)26-27-24(29)33-16-23(31)28-13-12-17-6-4-5-7-18(17)15-28/h4-11H,3,12-16H2,1-2H3,(H,25,30)InChIKey
XHHYNSWPSFDKAR-UHFFFAOYSA-NSynonyms
2(5((2(34DIHYDROISOQUINOLIN2(1H)YL)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)N(4METHOXYPHENYL)ACETAMIDE
2(5(2(34DIHYDRO1HISOQUINOLIN2YL)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)N(4METHOXYPHENYL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)N2CCC3=CC=CC=C3C2)CC(=O)NC4=CC=C(C=C4)OC
InChI=1SC24H27N5O3Sc132921(1422(30)251981020(322)11919)262724(29)331623(31)28131217645718(17)1528h411H31216H212H3(H2530)
MFCD07399378
ZINC000009263640
ZINC09263640
ZINC9263640
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