Vitas-M small molecule compound
ethyl 5-methyl-7-[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Catalog ID
STK914738
SMILES CCOC(=O)C1=C(C)Nc2n(C1c1cn(nc1c1cccs1)c1ccccc1)ncn2
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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 C22H20N6O2S MW 432.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N6O2S/c1-3-30-21(29)18-14(2)25-22-23-13-24-28(22)20(18)16-12-27(15-8-5-4-6-9-15)26-19(16)17-10-7-11-31-17/h4-13,20H,3H2,1-2H3,(H,23,24,25)InChIKey
SFYYTLXRBRQOHQ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N=C2N=CNN2C1C3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5)C
ethyl5methyl7(1phenyl3(thiophen2yl)1Hpyrazol4yl)47dihydro(124)triazolo(15a)pyrimidine6carboxylate
ETHYL5METHYL7(1PHENYL3THIOPHEN2YLPYRAZOL4YL)17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
InChI=1SC22H20N6O2Sc133021(29)1814(2)252223132428(22)20(18)161227(158546915)2619(16)17107113117h41320H3H212H3(H232425)
MFCD05033246
ZINC000008662404
ZINC000008662405
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