Vitas-M small molecule compound
2-{[4-(2-methylpropyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(trifluoromethyl)phenyl]acetamide
Catalog ID
STL122501
SMILES CC(Cn1c(SCC(=O)Nc2ccc(cc2)C(F)(F)F)nnc1c1cccnc1)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 C20H20F3N5OS MW 435.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20F3N5OS/c1-13(2)11-28-18(14-4-3-9-24-10-14)26-27-19(28)30-12-17(29)25-16-7-5-15(6-8-16)20(21,22)23/h3-10,13H,11-12H2,1-2H3,(H,25,29)InChIKey
WATBHNRKQUKDAF-UHFFFAOYSA-NSynonyms
2((4(2methylpropyl)5(pyridin3yl)4H124triazol3yl)sulfanyl)N(4(trifluoromethyl)phenyl)acetamide
2((4(2methylpropyl)5pyridin3yl124triazol3yl)sulfanyl)N(4(trifluoromethyl)phenyl)acetamide
CC(C)CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(F)(F)F)C3=CN=CC=C3
InChI=1SC20H20F3N5OSc113(2)112818(14439241014)262719(28)301217(29)25167515(6816)20(2122)23h31013H1112H212H3(H2529)
MFCD18434951
ZINC000010231082
ZINC10231082
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