Vitas-M small molecule compound
(2E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide
Catalog ID
STK815519
SMILES N#C/C(=C\c1cc(Br)c(c(c1)OC)O)/C(=O)NC1CCS(=O)(=O)C1
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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 C15H15BrN2O5S MW 415.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15BrN2O5S/c1-23-13-6-9(5-12(16)14(13)19)4-10(7-17)15(20)18-11-2-3-24(21,22)8-11/h4-6,11,19H,2-3,8H2,1H3,(H,18,20)/b10-4+InChIKey
DBSLXHQWWOWVCC-ONNFQVAWSA-NSynonyms
618065-29-5(2E)3(3bromo4hydroxy5methoxyphenyl)2cyanoN(11dioxidotetrahydrothiophen3yl)prop2enamide
(2E)3(3BROMO4HYDROXY5METHOXYPHENYL)2CYANON(11DIOXO1
(E)3(3BROMO4HYDROXY5METHOXYPHENYL)2CYANON(11DIOXOTHIOLAN3YL)PROP2ENAMIDE
618065295
COC1=C(C(=CC(=C1)C=C(C#N)C(=O)NC2CCS(=O)(=O)C2)Br)O
InChI=1SC15H15BrN2O5Sc1231369(512(16)14(13)19)410(717)15(20)18112324(2122)811h461119H238H21H3(H1820)b104+
MFCD03508621
N#CC(=Cc1cc(Br)c(c(c1)OC)O)C(=O)NC1CCS(=O)(=O)C1
ZINC000002695931
ZINC000011024139
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