Vitas-M small molecule compound
methyl 4-[3-(2,5-dimethylphenyl)-1-phenyl-1H-pyrazol-4-yl]-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK821034
SMILES COC(=O)C1=C(C)NC(=S)NC1c1cn(nc1c1cc(C)ccc1C)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 C24H24N4O2S MW 432.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N4O2S/c1-14-10-11-15(2)18(12-14)21-19(13-28(27-21)17-8-6-5-7-9-17)22-20(23(29)30-4)16(3)25-24(31)26-22/h5-13,22H,1-4H3,(H2,25,26,31)InChIKey
CRNCWWNPXBXTOW-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1)C)C2=NN(C=C2C3C(=C(NC(=S)N3)C)C(=O)OC)C4=CC=CC=C4
InChI=1SC24H24N4O2Sc114101115(2)18(1214)2119(1328(2721)178657917)2220(23(29)304)16(3)2524(31)2622h51322H14H3(H2252631)
methyl4(3(25dimethylphenyl)1phenyl1Hpyrazol4yl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
methyl4(3(25dimethylphenyl)1phenylpyrazol4yl)6methyl2sulfanylidene34dihydro1Hpyrimidine5carboxylate
MFCD03462558
ZINC000026962791
ZINC000026962801
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