Vitas-M small molecule compound
3,4-dichloro-N-[2-(5-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)ethyl]benzamide
Catalog ID
STK245738
SMILES CCn1c(CCNC(=O)c2ccc(c(c2)Cl)Cl)nnc1SCC(=O)NC1CCCCC1
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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 C21H27Cl2N5O2S MW 484.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27Cl2N5O2S/c1-2-28-18(10-11-24-20(30)14-8-9-16(22)17(23)12-14)26-27-21(28)31-13-19(29)25-15-6-4-3-5-7-15/h8-9,12,15H,2-7,10-11,13H2,1H3,(H,24,30)(H,25,29)InChIKey
JDIYREKAKIINAI-UHFFFAOYSA-NSynonyms
34DICHLORON(2(5((2(CYCLOHEXYLAMINO)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)ETHYL)BENZAMIDE
34dichloroN(2(5(2(cyclohexylamino)2oxoethyl)sulfanyl4ethyl124triazol3yl)ethyl)benzamide
CCN1C(=NN=C1SCC(=O)NC2CCCCC2)CCNC(=O)C3=CC(=C(C=C3)Cl)Cl
InChI=1SC21H27Cl2N5O2Sc122818(10112420(30)148916(22)17(23)1214)262721(28)311319(29)25156435715h891215H27101113H21H3(H2430)(H2529)
MFCD08670433
ZINC000009327965
ZINC09327965
ZINC9327965
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