Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,6-difluorophenyl)acetamide
Catalog ID
STL122579
SMILES O=C(Nc1c(F)cccc1F)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(17-10-13-6-3-4-9-16(13)29-17)25-26-21(27)30-11-18(28)24-19-14(22)7-5-8-15(19)23/h3-10,12H,11H2,1-2H3,(H,24,28)InChIKey
OINYXADJNASUMZ-UHFFFAOYSA-NSynonyms
2((5(1benzofuran2yl)4(propan2yl)4H124triazol3yl)sulfanyl)N(26difluorophenyl)acetamide
2((5(1benzofuran2yl)4propan2yl124triazol3yl)sulfanyl)N(26difluorophenyl)acetamide
CC(C)N1C(=NN=C1SCC(=O)NC2=C(C=CC=C2F)F)C3=CC4=CC=CC=C4O3
InChI=1SC21H18F2N4O2Sc112(2)2720(171013634916(13)2917)252621(27)301118(28)241914(22)75815(19)23h31012H11H212H3(H2428)
MFCD18434656
ZINC000028211397
ZINC28211397
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