Vitas-M small molecule compound
ethyl 3,5-dimethyl-4-{[3-(trifluoromethyl)-1H-1,2,4-triazol-5-yl]carbamoyl}-1H-pyrrole-2-carboxylate
Catalog ID
STL310779
SMILES CCOC(=O)c1[nH]c(c(c1C)C(=O)Nc1[nH]nc(n1)C(F)(F)F)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 C13H14F3N5O3 MW 345.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14F3N5O3/c1-4-24-10(23)8-5(2)7(6(3)17-8)9(22)18-12-19-11(20-21-12)13(14,15)16/h17H,4H2,1-3H3,(H2,18,19,20,21,22)InChIKey
XLEHECHCKFNXHT-UHFFFAOYSA-NSynonyms
1442077-52-21442077522
CCOC(=O)c1(nH)c(c(c1C)C(=O)Nc1(nH)nc(n1)C(F)(F)F)C
CCOC(=O)c1(nH)c(c(c1C)C(=O)Nc1n(nH)c(n1)C(F)(F)F)C
CCOC(=O)C1=C(C(=C(N1)C)C(=O)NC2=NNC(=N2)C(F)(F)F)C
ethyl35dimethyl4((3(trifluoromethyl)1H124triazol5yl)carbamoyl)1Hpyrrole2carboxylate
ethyl35dimethyl4((5(trifluoromethyl)1H124triazol3yl)carbamoyl)1Hpyrrole2carboxylate
InChI=1SC13H14F3N5O3c142410(23)85(2)7(6(3)178)9(22)18121911(202112)13(1415)16h17H4H213H3(H21819202122)
MFCD28025723
ZINC000095473595
ZINC95473595
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