Vitas-M small molecule compound
(5Z)-5-{3-bromo-4-[(3-nitrobenzyl)oxy]benzylidene}-1,3-dimethyl-2-thioxoimidazolidin-4-one
Catalog ID
STL369778
SMILES S=C1N(C)C(=O)/C(=C/c2ccc(c(c2)Br)OCc2cccc(c2)[N+](=O)[O-])/N1C
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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 C19H16BrN3O4S MW 462.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16BrN3O4S/c1-21-16(18(24)22(2)19(21)28)10-12-6-7-17(15(20)9-12)27-11-13-4-3-5-14(8-13)23(25)26/h3-10H,11H2,1-2H3/b16-10-InChIKey
YPIOOWLUHUKMOQ-YBEGLDIGSA-NSynonyms
(5Z)5((3BROMO4((3NITROPHENYL)METHOXY)PHENYL)METHYLIDENE)13DIMETHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(3bromo4((3nitrobenzyl)oxy)benzylidene)13dimethyl2thioxoimidazolidin4one
CN1C(=CC2=CC(=C(C=C2)OCC3=CC(=CC=C3)(N+)(=O)(O))Br)C(=O)N(C1=S)C
InChI=1SC19H16BrN3O4Sc12116(18(24)22(2)19(21)28)10126717(15(20)912)27111343514(813)23(25)26h310H11H212H3b1610
MFCD03716694
S=C1N(C)C(=O)C(=Cc2ccc(c(c2)Br)OCc2cccc(c2)(N+)(=O)(O))N1C
ZINC000009296070
ZINC09296070
ZINC9296070
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