Vitas-M small molecule compound
methyl (2Z)-5-methyl-2-[({5-oxo-1-[3-(trifluoromethoxy)phenyl]pyrrolidin-3-yl}carbonyl)imino]-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL410054
SMILES COC(=O)c1[nH]/c(=N/C(=O)C2CC(=O)N(C2)c2cccc(c2)OC(F)(F)F)/sc1C
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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 C18H16F3N3O5S MW 443.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16F3N3O5S/c1-9-14(16(27)28-2)22-17(30-9)23-15(26)10-6-13(25)24(8-10)11-4-3-5-12(7-11)29-18(19,20)21/h3-5,7,10H,6,8H2,1-2H3,(H,22,23,26)InChIKey
RSCBIVRDCDLGKT-UHFFFAOYSA-NSynonyms
1574309-45-71574309457
CC1=C(N=C(S1)NC(=O)C2CC(=O)N(C2)C3=CC(=CC=C3)OC(F)(F)F)C(=O)OC
COC(=O)c1(nH)c(=NC(=O)C2CC(=O)N(C2)c2cccc(c2)OC(F)(F)F)sc1C
InChI=1SC18H16F3N3O5Sc1914(16(27)282)2217(309)2315(26)10613(25)24(810)1143512(711)2918(1920)21h35710H68H212H3(H222326)
methyl(2Z)5methyl2(((5oxo1(3(trifluoromethoxy)phenyl)pyrrolidin3yl)carbonyl)imino)23dihydro13thiazole4carboxylate
methyl5methyl2((5oxo1(3(trifluoromethoxy)phenyl)pyrrolidine3carbonyl)amino)13thiazole4carboxylate
MFCD30706016
ZINC000096118609
ZINC000096118610
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