Vitas-M small molecule compound

ethyl 5-(trifluoromethyl)-7-(2,3,4-trimethoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

Catalog ID
STK914737
SMILES CCOC(=O)C1=C(Nc2n(C1c1ccc(c(c1OC)OC)OC)ncn2)C(F)(F)F

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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 C18H19F3N4O5 MW 428.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19F3N4O5/c1-5-30-16(26)11-12(9-6-7-10(27-2)14(29-4)13(9)28-3)25-17(22-8-23-25)24-15(11)18(19,20)21/h6-8,12H,5H2,1-4H3,(H,22,23,24)
InChIKey
YISSKYWXQTWBOL-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N=C2N=CNN2C1C3=C(C(=C(C=C3)OC)OC)OC)C(F)(F)F
ETHYL5(TRIFLUOROMETHYL)7(234TRIMETHOXYPHENYL)17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
ethyl5(trifluoromethyl)7(234trimethoxyphenyl)47dihydro(124)triazolo(15a)pyrimidine6carboxylate
InChI=1SC18H19F3N4O5c153016(26)1112(96710(272)14(294)13(9)283)2517(2282325)2415(11)18(1920)21h6812H5H214H3(H222324)
MFCD15110139
ZINC000013130872
ZINC000013130874

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.