Vitas-M small molecule compound
ethyl 6-methyl-4-(4-{[(4-methylphenyl)sulfonyl]oxy}phenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK758684
SMILES CCOC(=O)C1=C(C)NC(=O)NC1c1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C
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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 C21H22N2O6S MW 430.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O6S/c1-4-28-20(24)18-14(3)22-21(25)23-19(18)15-7-9-16(10-8-15)29-30(26,27)17-11-5-13(2)6-12-17/h5-12,19H,4H2,1-3H3,(H2,22,23,25)InChIKey
KMVRJCZGOYFDCE-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)C)C
ethyl6methyl4(4(((4methylphenyl)sulfonyl)oxy)phenyl)2oxo1234tetrahydropyrimidine5carboxylate
ETHYL6METHYL4(4(4METHYLPHENYL)SULFONYLOXYPHENYL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC21H22N2O6Sc142820(24)1814(3)2221(25)2319(18)157916(10815)2930(2627)1711513(2)61217h51219H4H213H3(H2222325)
MFCD01460132
ZINC000008853721
ZINC000012412560
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