Vitas-M small molecule compound
(5Z)-5-(4-hydroxy-3-methoxy-5-nitrobenzylidene)-3-methyl-2-thioxoimidazolidin-4-one
Catalog ID
STL369108
SMILES COc1cc(/C=C/2\NC(=S)N(C2=O)C)cc(c1O)[N+](=O)[O-]
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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 C12H11N3O5S MW 309.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11N3O5S/c1-14-11(17)7(13-12(14)21)3-6-4-8(15(18)19)10(16)9(5-6)20-2/h3-5,16H,1-2H3,(H,13,21)/b7-3-InChIKey
VOJXGUODKSPOJG-CLTKARDFSA-NSynonyms
(5Z)5((4HYDROXY3METHOXY5NITROPHENYL)METHYLIDENE)3METHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(4hydroxy3methoxy5nitrobenzylidene)3methyl2thioxoimidazolidin4one
CN1C(=O)C(=CC2=CC(=C(C(=C2)OC)O)(N+)(=O)(O))NC1=S
COc1cc(C=C2NC(=S)N(C2=O)C)cc(c1O)(N+)(=O)(O)
InChI=1SC12H11N3O5Sc11411(17)7(1312(14)21)3648(15(18)19)10(16)9(56)202h3516H12H3(H1321)b73
MFCD05039760
ZINC000009295898
ZINC9295898
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