Vitas-M small molecule compound
2-(5-{[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)-N-(2-fluorophenyl)acetamide
Catalog ID
STK221942
SMILES CCn1c(SCC(=O)Nc2nc3c(s2)cccc3)nnc1CC(=O)Nc1ccccc1F
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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 C21H19FN6O2S2 MW 470.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19FN6O2S2/c1-2-28-17(11-18(29)23-14-8-4-3-7-13(14)22)26-27-21(28)31-12-19(30)25-20-24-15-9-5-6-10-16(15)32-20/h3-10H,2,11-12H2,1H3,(H,23,29)(H,24,25,30)InChIKey
LXVNVJLEXNBXRT-UHFFFAOYSA-NSynonyms
2(5((2(13benzothiazol2ylamino)2oxoethyl)sulfanyl)4ethyl4H124triazol3yl)N(2fluorophenyl)acetamide
2(5(2(13BENZOTHIAZOL2YLAMINO)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)N(2FLUOROPHENYL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)NC2=NC3=CC=CC=C3S2)CC(=O)NC4=CC=CC=C4F
InChI=1SC21H19FN6O2S2c122817(1118(29)2314843713(14)22)262721(28)311219(30)252024159561016(15)3220h310H21112H21H3(H2329)(H242530)
MFCD07399146
ZINC000009303096
ZINC09303096
ZINC9303096
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