Vitas-M small molecule compound
(5Z)-3-(4-ethoxyphenyl)-5-(4-hydroxy-3-nitrobenzylidene)-1-methyl-2-thioxoimidazolidin-4-one
Catalog ID
STL378779
SMILES CCOc1ccc(cc1)N1C(=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 C19H17N3O5S MW 399.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O5S/c1-3-27-14-7-5-13(6-8-14)21-18(24)16(20(2)19(21)28)11-12-4-9-17(23)15(10-12)22(25)26/h4-11,23H,3H2,1-2H3/b16-11-InChIKey
GXNONVBMZWYTOR-WJDWOHSUSA-NSynonyms
(5Z)3(4ETHOXYPHENYL)5((4HYDROXY3NITROPHENYL)METHYLIDENE)1METHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)3(4ethoxyphenyl)5(4hydroxy3nitrobenzylidene)1methyl2thioxoimidazolidin4one
CCOC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)O)(N+)(=O)(O))N(C2=S)C
CCOc1ccc(cc1)N1C(=O)C(=Cc2ccc(c(c2)(N+)(=O)(O))O)N(C1=S)C
InChI=1SC19H17N3O5Sc1327147513(6814)2118(24)16(20(2)19(21)28)11124917(23)15(1012)22(25)26h41123H3H212H3b1611
MFCD03716613
ZINC000015011070
ZINC15011070
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