Vitas-M small molecule compound
(2E)-3-(5-bromo-2-methoxyphenyl)-2-cyanoprop-2-enethioamide
Catalog ID
STK728576
SMILES COc1ccc(cc1/C=C(/C(=S)N)\C#N)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 C11H9BrN2OS MW 297.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H9BrN2OS/c1-15-10-3-2-9(12)5-7(10)4-8(6-13)11(14)16/h2-5H,1H3,(H2,14,16)/b8-4+InChIKey
VHGHITVPTBDYRG-XBXARRHUSA-NSynonyms
893625-90-6(2E)3(5bromo2methoxyphenyl)2cyanoprop2enethioamide
(E)3(5BROMO2METHOXYPHENYL)2CYANOPROP2ENETHIOAMIDE
893625906
COC1=C(C=C(C=C1)Br)C=C(C#N)C(=S)N
COc1ccc(cc1C=C(C(=S)N)C#N)Br
InChI=1SC11H9BrN2OSc11510329(12)57(10)48(613)11(14)16h25H1H3(H21416)b84+
MFCD06775831
ZINC000006659079
ZINC06659079
ZINC6659079
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