Vitas-M small molecule compound
2-bromo-N-[1-(5-{[2-(4,5-dihydro-1,3-thiazol-2-ylamino)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)ethyl]benzamide
Catalog ID
STK231230
SMILES CCn1c(SCC(=O)NC2=NCCS2)nnc1C(NC(=O)c1ccccc1Br)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 C18H21BrN6O2S2 MW 497.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21BrN6O2S2/c1-3-25-15(11(2)21-16(27)12-6-4-5-7-13(12)19)23-24-18(25)29-10-14(26)22-17-20-8-9-28-17/h4-7,11H,3,8-10H2,1-2H3,(H,21,27)(H,20,22,26)InChIKey
VJLSESHKAODNBR-UHFFFAOYSA-NSynonyms
2bromoN(1(5((2(45dihydro13thiazol2ylamino)2oxoethyl)sulfanyl)4ethyl4H124triazol3yl)ethyl)benzamide
2BROMON(1(5((45DIHYDROTHIAZOL2YLCARBAMOYL)METHYLSULFANYL)4ETHYL4H(124)TRIAZOL3YL)ETHYL)BENZAMIDE
2BROMON(1(5(2(45DIHYDRO13THIAZOL2YLAMINO)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)ETHYL)BENZAMIDE
CCN1C(=NN=C1SCC(=O)NC2=NCCS2)C(C)NC(=O)C3=CC=CC=C3Br
InChI=1SC18H21BrN6O2S2c132515(11(2)2116(27)12645713(12)19)232418(25)291014(26)221720892817h4711H3810H212H3(H2127)(H202226)
MFCD07790679
ZINC000009304174
ZINC000009304176
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