Vitas-M small molecule compound
(5E)-5-{4-[(2-chlorobenzyl)oxy]benzylidene}-1-ethyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL055055
SMILES CCN1C(=NC(=O)/C(=C\c2ccc(cc2)OCc2ccccc2Cl)/C1=O)S
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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 C20H17ClN2O3S MW 400.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN2O3S/c1-2-23-19(25)16(18(24)22-20(23)27)11-13-7-9-15(10-8-13)26-12-14-5-3-4-6-17(14)21/h3-11H,2,12H2,1H3,(H,22,24,27)/b16-11+InChIKey
YIJNLFDOFACERT-LFIBNONCSA-NSynonyms
714945-69-4(5E)5((4((2CHLOROPHENYL)METHOXY)PHENYL)METHYLIDENE)1ETHYL2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5(4((2chlorobenzyl)oxy)benzylidene)1ethyl2sulfanylpyrimidine46(1H5H)dione
714945694
CCN1C(=NC(=O)C(=Cc2ccc(cc2)OCc2ccccc2Cl)C1=O)S
CCN1C(=O)C(=CC2=CC=C(C=C2)OCC3=CC=CC=C3Cl)C(=O)NC1=S
InChI=1SC20H17ClN2O3Sc122319(25)16(18(24)2220(23)27)11137915(10813)261214534617(14)21h311H212H21H3(H222427)b1611+
MFCD05737132
ZINC000009328601
ZINC9328601
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