Vitas-M small molecule compound
(5Z)-5-{3-chloro-4-[(4-nitrobenzyl)oxy]benzylidene}-3-ethyl-2-thioxoimidazolidin-4-one
Catalog ID
STL371590
SMILES CCN1C(=S)N/C(=C\c2ccc(c(c2)Cl)OCc2ccc(cc2)[N+](=O)[O-])/C1=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 C19H16ClN3O4S MW 417.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClN3O4S/c1-2-22-18(24)16(21-19(22)28)10-13-5-8-17(15(20)9-13)27-11-12-3-6-14(7-4-12)23(25)26/h3-10H,2,11H2,1H3,(H,21,28)/b16-10-InChIKey
MBFQWXNRNPLUMB-YBEGLDIGSA-NSynonyms
(5Z)5((3CHLORO4((4NITROPHENYL)METHOXY)PHENYL)METHYLIDENE)3ETHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(3chloro4((4nitrobenzyl)oxy)benzylidene)3ethyl2thioxoimidazolidin4one
CCN1C(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)(N+)(=O)(O))Cl)NC1=S
CCN1C(=S)NC(=Cc2ccc(c(c2)Cl)OCc2ccc(cc2)(N+)(=O)(O))C1=O
InChI=1SC19H16ClN3O4Sc122218(24)16(2119(22)28)10135817(15(20)913)2711123614(7412)23(25)26h310H211H21H3(H2128)b1610
MFCD03712502
ZINC000009295974
ZINC9295974
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