Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-fluorophenyl)butanamide
Catalog ID
STK297725
SMILES CCC(C(=O)Nc1ccccc1F)Sc1nnc(n1CC)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 C22H21FN4O2S MW 424.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21FN4O2S/c1-3-19(21(28)24-16-11-7-6-10-15(16)23)30-22-26-25-20(27(22)4-2)18-13-14-9-5-8-12-17(14)29-18/h5-13,19H,3-4H2,1-2H3,(H,24,28)InChIKey
PXCAGNRRTDYVTN-UHFFFAOYSA-NSynonyms
2((5(1benzofuran2yl)4ethyl124triazol3yl)sulfanyl)N(2fluorophenyl)butanamide
2((5(1benzofuran2yl)4ethyl4H124triazol3yl)sulfanyl)N(2fluorophenyl)butanamide
2(5BENZOFURAN2YL4ETHYL4H(124)TRIAZOL3YLSULFANYL)N(2FLUOROPHENYL)BUTYRAMIDE
CCC(C(=O)NC1=CC=CC=C1F)SC2=NN=C(N2CC)C3=CC4=CC=CC=C4O3
InChI=1SC22H21FN4O2Sc1319(21(28)241611761015(16)23)3022262520(27(22)42)1813149581217(14)2918h51319H34H212H3(H2428)
MFCD09961120
ZINC000013956580
ZINC000013956581
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