Vitas-M small molecule compound
benzyl 4-(3,4-dimethoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK812691
SMILES COc1cc(ccc1OC)C1NC(=S)NC(=C1C(=O)OCc1ccccc1)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 C21H22N2O4S MW 398.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O4S/c1-13-18(20(24)27-12-14-7-5-4-6-8-14)19(23-21(28)22-13)15-9-10-16(25-2)17(11-15)26-3/h4-11,19H,12H2,1-3H3,(H2,22,23,28)InChIKey
GWHVKCLGKKDIPF-UHFFFAOYSA-NSynonyms
616212-53-4616212534
BENZYL4(34DIMETHOXYPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
benzyl4(34dimethoxyphenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
CC1=C(C(NC(=S)N1)C2=CC(=C(C=C2)OC)OC)C(=O)OCC3=CC=CC=C3
InChI=1SC21H22N2O4Sc11318(20(24)2712147546814)19(2321(28)2213)1591016(252)17(1115)263h41119H12H213H3(H2222328)
MFCD03132701
ZINC000004263241
ZINC000004263242
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Check stock on Vitas-MAvailable files
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