Vitas-M small molecule compound
(5E)-5-{5-bromo-2-[(4-nitrobenzyl)oxy]benzylidene}-2-thioxoimidazolidin-4-one
Catalog ID
STL428334
SMILES S=C1NC(=O)/C(=C\c2cc(Br)ccc2OCc2ccc(cc2)[N+](=O)[O-])/N1
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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 C17H12BrN3O4S MW 434.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12BrN3O4S/c18-12-3-6-15(11(7-12)8-14-16(22)20-17(26)19-14)25-9-10-1-4-13(5-2-10)21(23)24/h1-8H,9H2,(H2,19,20,22,26)/b14-8+InChIKey
MBDVSOXLTWOOHI-RIYZIHGNSA-NSynonyms
(5E)5((5BROMO2((4NITROPHENYL)METHOXY)PHENYL)METHYLIDENE)2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5E)5(5bromo2((4nitrobenzyl)oxy)benzylidene)2thioxoimidazolidin4one
C1=CC(=CC=C1COC2=C(C=C(C=C2)Br)C=C3C(=O)NC(=S)N3)(N+)(=O)(O)
InChI=1SC17H12BrN3O4Sc18123615(11(712)81416(22)2017(26)1914)259101413(5210)21(23)24h18H9H2(H219202226)b148+
MFCD04083223
S=C1NC(=O)C(=Cc2cc(Br)ccc2OCc2ccc(cc2)(N+)(=O)(O))N1
ZINC000009310310
ZINC9310310
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