Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-difluorophenyl)acetamide
Catalog ID
STL122502
SMILES O=C(Nc1cc(F)ccc1F)CSc1nnc(n1C(C)C)c1cc2c(o1)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 C21H18F2N4O2S MW 428.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18F2N4O2S/c1-12(2)27-20(18-9-13-5-3-4-6-17(13)29-18)25-26-21(27)30-11-19(28)24-16-10-14(22)7-8-15(16)23/h3-10,12H,11H2,1-2H3,(H,24,28)InChIKey
LXIMEZMEFWOFTK-UHFFFAOYSA-NSynonyms
2((5(1benzofuran2yl)4(propan2yl)4H124triazol3yl)sulfanyl)N(25difluorophenyl)acetamide
2((5(1benzofuran2yl)4propan2yl124triazol3yl)sulfanyl)N(25difluorophenyl)acetamide
CC(C)N1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)F)F)C3=CC4=CC=CC=C4O3
InChI=1SC21H18F2N4O2Sc112(2)2720(18913534617(13)2918)252621(27)301119(28)24161014(22)7815(16)23h31012H11H212H3(H2428)
MFCD18434659
ZINC000010174766
ZINC10174766
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