Vitas-M small molecule compound
(5Z)-3-ethyl-5-(4-hydroxy-3-nitrobenzylidene)-1-methyl-2-thioxoimidazolidin-4-one
Catalog ID
STL369643
SMILES CCN1C(=O)/C(=C/c2ccc(c(c2)[N+](=O)[O-])O)/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 C13H13N3O4S MW 307.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N3O4S/c1-3-15-12(18)10(14(2)13(15)21)7-8-4-5-11(17)9(6-8)16(19)20/h4-7,17H,3H2,1-2H3/b10-7-InChIKey
VJRZJOREYYDZGK-YFHOEESVSA-NSynonyms
(5Z)3ETHYL5((4HYDROXY3NITROPHENYL)METHYLIDENE)1METHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)3ethyl5(4hydroxy3nitrobenzylidene)1methyl2thioxoimidazolidin4one
CCN1C(=O)C(=CC2=CC(=C(C=C2)O)(N+)(=O)(O))N(C1=S)C
CCN1C(=O)C(=Cc2ccc(c(c2)(N+)(=O)(O))O)N(C1=S)C
InChI=1SC13H13N3O4Sc131512(18)10(14(2)13(15)21)784511(17)9(68)16(19)20h4717H3H212H3b107
MFCD03716470
ZINC000037219723
ZINC37219723
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