Vitas-M small molecule compound

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

Catalog ID
STK124556
SMILES CCOC(=O)C1=C(Nc2n(C1c1ccccc1C(F)(F)F)ncn2)c1ccccc1

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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 C21H17F3N4O2 MW 414.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17F3N4O2/c1-2-30-19(29)16-17(13-8-4-3-5-9-13)27-20-25-12-26-28(20)18(16)14-10-6-7-11-15(14)21(22,23)24/h3-12,18H,2H2,1H3,(H,25,26,27)
InChIKey
YVLNEAPOEZUMRE-UHFFFAOYSA-N
Synonyms
694496-78-1
694496781
CCOC(=O)C1=C(N=C2N=CNN2C1C3=CC=CC=C3C(F)(F)F)C4=CC=CC=C4
ETHYL5PHENYL7(2(TRIFLUOROMETHYL)PHENYL)17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
ETHYL5PHENYL7(2(TRIFLUOROMETHYL)PHENYL)478TRIHYDRO124TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
ETHYL5PHENYL7(2(TRIFLUOROMETHYL)PHENYL)47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
InChI=1SC21H17F3N4O2c123019(29)1617(138435913)272025122628(20)18(16)1410671115(14)21(2223)24h31218H2H21H3(H252627)
MFCD04186647
ZINC000001129246
ZINC000001129247

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Available files

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