Vitas-M small molecule compound
(5Z)-3-(4-ethoxyphenyl)-5-[(6-methoxy-1,3-benzodioxol-5-yl)methylidene]-1-methyl-2-thioxoimidazolidin-4-one
Catalog ID
STL369486
SMILES CCOc1ccc(cc1)N1C(=O)/C(=C/c2cc3OCOc3cc2OC)/N(C1=S)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 C21H20N2O5S MW 412.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O5S/c1-4-26-15-7-5-14(6-8-15)23-20(24)16(22(2)21(23)29)9-13-10-18-19(28-12-27-18)11-17(13)25-3/h5-11H,4,12H2,1-3H3/b16-9-InChIKey
KYVJBUBETMIULZ-SXGWCWSVSA-NSynonyms
(5Z)3(4ETHOXYPHENYL)5((6METHOXY13BENZODIOXOL5YL)METHYLIDENE)1METHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)3(4ethoxyphenyl)5((6methoxy13benzodioxol5yl)methylidene)1methyl2thioxoimidazolidin4one
CCOC1=CC=C(C=C1)N2C(=O)C(=CC3=CC4=C(C=C3OC)OCO4)N(C2=S)C
CCOc1ccc(cc1)N1C(=O)C(=Cc2cc3OCOc3cc2OC)N(C1=S)C
InChI=1SC21H20N2O5Sc1426157514(6815)2320(24)16(22(2)21(23)29)913101819(28122718)1117(13)253h511H412H213H3b169
MFCD03716495
ZINC000001114154
ZINC01114154
ZINC1114154
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