Vitas-M small molecule compound
5-chloro-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-ethoxybenzyl)-2-(ethylsulfanyl)pyrimidine-4-carboxamide
Catalog ID
STK910402
SMILES CCOc1ccc(cc1)CN(C(=O)c1nc(SCC)ncc1Cl)C1CCS(=O)(=O)C1
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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 C20H24ClN3O4S2 MW 470.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24ClN3O4S2/c1-3-28-16-7-5-14(6-8-16)12-24(15-9-10-30(26,27)13-15)19(25)18-17(21)11-22-20(23-18)29-4-2/h5-8,11,15H,3-4,9-10,12-13H2,1-2H3InChIKey
UGOAOKOPLZXJIE-UHFFFAOYSA-NSynonyms
873682-27-05chloroN(11dioxidotetrahydrothiophen3yl)N(4ethoxybenzyl)2(ethylsulfanyl)pyrimidine4carboxamide
5chloroN(11dioxothiolan3yl)N((4ethoxyphenyl)methyl)2ethylsulfanylpyrimidine4carboxamide
873682270
CCOC1=CC=C(C=C1)CN(C2CCS(=O)(=O)C2)C(=O)C3=NC(=NC=C3Cl)SCC
InChI=1SC20H24ClN3O4S2c1328167514(6816)1224(1591030(2627)1315)19(25)1817(21)112220(2318)2942h581115H349101213H212H3
MFCD07425352
ZINC000008869043
ZINC000008869045
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