Vitas-M small molecule compound

(2E)-2-{3-bromo-4-[(2-chlorobenzyl)oxy]-5-methoxybenzylidene}hydrazinecarbothioamide

Catalog ID
STK397259
SMILES COc1cc(/C=N/NC(=S)N)cc(c1OCc1ccccc1Cl)Br

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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 C16H15BrClN3O2S MW 428.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15BrClN3O2S/c1-22-14-7-10(8-20-21-16(19)24)6-12(17)15(14)23-9-11-4-2-3-5-13(11)18/h2-8H,9H2,1H3,(H3,19,21,24)/b20-8+
InChIKey
YZHFKYKZHVETEP-DNTJNYDQSA-N
Synonyms

((E)(3BROMO4((2CHLOROPHENYL)METHOXY)5METHOXYPHENYL)METHYLIDENEAMINO)THIOUREA
(2E)2(3BROMO4((2CHLOROBENZYL)OXY)5METHOXYBENZYLIDENE)HYDRAZINECARBOTHIOAMIDE
3BROMO4((2CHLOROBENZYL)OXY)5METHOXYBENZALDEHYDETHIOSEMICARBAZONE
COC1=C(C(=CC(=C1)C=NNC(=S)N)Br)OCC2=CC=CC=C2Cl
COc1cc(C=NNC(=S)N)cc(c1OCc1ccccc1Cl)Br
InChI=1SC16H15BrClN3O2Sc12214710(8202116(19)24)612(17)15(14)23911423513(11)18h28H9H21H3(H3192124)b208+
MFCD02203173
ZINC000000657663
ZINC33332922

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Available files

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