Vitas-M small molecule compound
(5Z)-5-(3-ethoxy-2-hydroxy-5-nitrobenzylidene)-3-ethyl-1-methyl-2-thioxoimidazolidin-4-one
Catalog ID
STL369645
SMILES CCOc1cc(cc(c1O)/C=C\1/C(=O)N(C(=S)N1C)CC)[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 C15H17N3O5S MW 351.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17N3O5S/c1-4-17-14(20)11(16(3)15(17)24)7-9-6-10(18(21)22)8-12(13(9)19)23-5-2/h6-8,19H,4-5H2,1-3H3/b11-7-InChIKey
LPKVZSBGEPRGIH-XFFZJAGNSA-NSynonyms
(5Z)5((3ETHOXY2HYDROXY5NITROPHENYL)METHYLIDENE)3ETHYL1METHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(3ethoxy2hydroxy5nitrobenzylidene)3ethyl1methyl2thioxoimidazolidin4one
CCN1C(=O)C(=CC2=CC(=CC(=C2O)OCC)(N+)(=O)(O))N(C1=S)C
CCOc1cc(cc(c1O)C=C1C(=O)N(C(=S)N1C)CC)(N+)(=O)(O)
InChI=1SC15H17N3O5Sc141714(20)11(16(3)15(17)24)79610(18(21)22)812(13(9)19)2352h6819H45H213H3b117
MFCD03716329
ZINC000015011140
ZINC15011140
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