Vitas-M small molecule compound
(5Z)-3-ethyl-5-[(6-methoxy-1,3-benzodioxol-5-yl)methylidene]-2-thioxoimidazolidin-4-one
Catalog ID
STL369485
SMILES COc1cc2OCOc2cc1/C=C/1\NC(=S)N(C1=O)CC
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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 C14H14N2O4S MW 306.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14N2O4S/c1-3-16-13(17)9(15-14(16)21)4-8-5-11-12(20-7-19-11)6-10(8)18-2/h4-6H,3,7H2,1-2H3,(H,15,21)/b9-4-InChIKey
DQKATKWKWWHCQN-WTKPLQERSA-NSynonyms
(5Z)3ETHYL5((6METHOXY13BENZODIOXOL5YL)METHYLIDENE)2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)3ethyl5((6methoxy13benzodioxol5yl)methylidene)2thioxoimidazolidin4one
CCN1C(=O)C(=CC2=CC3=C(C=C2OC)OCO3)NC1=S
COc1cc2OCOc2cc1C=C1NC(=S)N(C1=O)CC
InChI=1SC14H14N2O4Sc131613(17)9(1514(16)21)4851112(2071911)610(8)182h46H37H212H3(H1521)b94
MFCD03269550
ZINC000000202528
ZINC00202528
ZINC202528
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