Vitas-M small molecule compound
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-{[4-(2-methylpropyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL379505
SMILES CC(Cn1c(SCC(=O)Nc2ccc(c(c2)C(F)(F)F)Cl)nnc1c1ccncc1)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 C20H19ClF3N5OS MW 469.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClF3N5OS/c1-12(2)10-29-18(13-5-7-25-8-6-13)27-28-19(29)31-11-17(30)26-14-3-4-16(21)15(9-14)20(22,23)24/h3-9,12H,10-11H2,1-2H3,(H,26,30)InChIKey
VQJDLPUNZYWBSH-UHFFFAOYSA-NSynonyms
CC(C)CN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F)C3=CC=NC=C3
InChI=1SC20H19ClF3N5OSc112(2)102918(1357258613)272819(29)311117(30)26143416(21)15(914)20(2223)24h3912H1011H212H3(H2630)
MFCD04210026
N(4chloro3(trifluoromethyl)phenyl)2((4(2methylpropyl)5(pyridin4yl)4H124triazol3yl)sulfanyl)acetamide
N(4CHLORO3(TRIFLUOROMETHYL)PHENYL)2((4(2METHYLPROPYL)5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000001139987
ZINC01139987
ZINC1139987
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