Vitas-M small molecule compound
methyl 4-[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK821569
SMILES COC(=O)C1=C(C)NC(=S)NC1c1cn(nc1c1ccc(cc1)F)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 C22H19FN4O2S MW 422.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19FN4O2S/c1-13-18(21(28)29-2)20(25-22(30)24-13)17-12-27(16-6-4-3-5-7-16)26-19(17)14-8-10-15(23)11-9-14/h3-12,20H,1-2H3,(H2,24,25,30)InChIKey
ABRFANTVSMDMKJ-UHFFFAOYSA-NSynonyms
CC1=C(C(NC(=S)N1)C2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4)C(=O)OC
InChI=1SC22H19FN4O2Sc11318(21(28)292)20(2522(30)2413)171227(166435716)2619(17)1481015(23)11914h31220H12H3(H2242530)
methyl4(3(4fluorophenyl)1phenyl1Hpyrazol4yl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
METHYL4(3(4FLUOROPHENYL)1PHENYLPYRAZOL4YL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
METHYL4(3(4FLUOROPHENYL)1PHENYLPYRAZOL4YL)6METHYL2THIOXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
MFCD03017204
ZINC000001164797
ZINC000001164798
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