Vitas-M small molecule compound
2-bromo-4-[(E)-(2-carbamothioylhydrazinylidene)methyl]-6-ethoxyphenyl benzoate
Catalog ID
STK400654
SMILES CCOc1cc(/C=N/NC(=S)N)cc(c1OC(=O)c1ccccc1)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 C17H16BrN3O3S MW 422.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16BrN3O3S/c1-2-23-14-9-11(10-20-21-17(19)25)8-13(18)15(14)24-16(22)12-6-4-3-5-7-12/h3-10H,2H2,1H3,(H3,19,21,25)/b20-10+InChIKey
MLSFQQOORJYYIM-KEBDBYFISA-NSynonyms
494761-84-1(2bromo4((E)(carbamothioylhydrazinylidene)methyl)6ethoxyphenyl)benzoate
2bromo4((E)(2carbamothioylhydrazinylidene)methyl)6ethoxyphenylbenzoate
494761841
CCOC1=C(C(=CC(=C1)C=NNC(=S)N)Br)OC(=O)C2=CC=CC=C2
CCOc1cc(C=NNC(=S)N)cc(c1OC(=O)c1ccccc1)Br
InChI=1SC17H16BrN3O3Sc122314911(10202117(19)25)813(18)15(14)2416(22)126435712h310H2H21H3(H3192125)b2010+
MFCD02256627
ZINC000002763201
ZINC33416684
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