Vitas-M small molecule compound
(2E)-3-(4-bromophenyl)-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)prop-2-enamide
Catalog ID
STK958924
SMILES N#Cc1c(NC(=O)/C=C/c2ccc(cc2)Br)sc2c1CCC(C2)C(C)(C)C
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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 C22H23BrN2OS MW 443.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23BrN2OS/c1-22(2,3)15-7-10-17-18(13-24)21(27-19(17)12-15)25-20(26)11-6-14-4-8-16(23)9-5-14/h4-6,8-9,11,15H,7,10,12H2,1-3H3,(H,25,26)/b11-6+InChIKey
IWAOPYIYVVRETN-IZZDOVSWSA-NSynonyms
544427-75-0(2E)3(4bromophenyl)N(6tertbutyl3cyano4567tetrahydro1benzothiophen2yl)prop2enamide
(E)3(4bromophenyl)N(6tertbutyl3cyano4567tetrahydro1benzothiophen2yl)prop2enamide
544427750
CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)C=CC3=CC=C(C=C3)Br
InChI=1SC22H23BrN2OSc122(23)157101718(1324)21(2719(17)1215)2520(26)116144816(23)9514h46891115H71012H213H3(H2526)b116+
MFCD02371932
N#Cc1c(NC(=O)C=Cc2ccc(cc2)Br)sc2c1CCC(C2)C(C)(C)C
ZINC000002753089
ZINC000002753091
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