Vitas-M small molecule compound

(5E)-5-[5-bromo-2-(naphthalen-1-ylmethoxy)benzylidene]-2-thioxoimidazolidin-4-one

Catalog ID
STK096891
SMILES S=C1NC(=O)/C(=C\c2cc(Br)ccc2OCc2cccc3c2cccc3)/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 C21H15BrN2O2S MW 439.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15BrN2O2S/c22-16-8-9-19(15(10-16)11-18-20(25)24-21(27)23-18)26-12-14-6-3-5-13-4-1-2-7-17(13)14/h1-11H,12H2,(H2,23,24,25,27)/b18-11+
InChIKey
RQVMPUZFTKGRQI-WOJGMQOQSA-N
Synonyms

(5E)5((5BROMO2(NAPHTHALEN1YLMETHOXY)PHENYL)METHYLIDENE)2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5E)5(5BROMO2(NAPHTHALEN1YLMETHOXY)BENZYLIDENE)2THIOXOIMIDAZOLIDIN4ONE
5(5BROMO2(1NAPHTHYLMETHOXY)BENZYLIDENE)2THIOXO4IMIDAZOLIDINONE
C1=CC=C2C(=C1)C=CC=C2COC3=C(C=C(C=C3)Br)C=C4C(=O)NC(=S)N4
InChI=1SC21H15BrN2O2Sc22168919(15(1016)111820(25)2421(27)2318)26121463513412717(13)14h111H12H2(H223242527)b1811+
MFCD01929158
S=C1NC(=O)C(=Cc2cc(Br)ccc2OCc2cccc3c2cccc3)N1
STK096891
ZINC000000665527
ZINC00665527
ZINC665527

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Available files

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