Vitas-M small molecule compound
ethyl 6-{[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]methyl}-4-(1-ethyl-1H-pyrazol-4-yl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK313640
SMILES CCOC(=O)C1=C(CSc2nc(C)cc(c2C#N)C)NC(=O)NC1c1cnn(c1)CC
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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 C21H24N6O3S MW 440.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N6O3S/c1-5-27-10-14(9-23-27)18-17(20(28)30-6-2)16(25-21(29)26-18)11-31-19-15(8-22)12(3)7-13(4)24-19/h7,9-10,18H,5-6,11H2,1-4H3,(H2,25,26,29)InChIKey
HZEDLQJJSCMKHC-UHFFFAOYSA-NSynonyms
1005654-99-81005654998
CCN1C=C(C=N1)C2C(=C(NC(=O)N2)CSC3=C(C(=CC(=N3)C)C)C#N)C(=O)OCC
ethyl6(((3cyano46dimethylpyridin2yl)sulfanyl)methyl)4(1ethyl1Hpyrazol4yl)2oxo1234tetrahydropyrimidine5carboxylate
ethyl6((3cyano46dimethylpyridin2yl)sulfanylmethyl)4(1ethylpyrazol4yl)2oxo34dihydro1Hpyrimidine5carboxylate
InChI=1SC21H24N6O3Sc15271014(92327)1817(20(28)3062)16(2521(29)2618)11311915(822)12(3)713(4)2419h791018H5611H214H3(H2252629)
MFCD05667248
ZINC000013960527
ZINC000013960528
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