Vitas-M small molecule compound
(2E)-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(2,6-dichlorophenyl)prop-2-enamide
Catalog ID
STK420803
SMILES N#Cc1c(NC(=O)/C=C/c2c(Cl)cccc2Cl)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 C22H22Cl2N2OS MW 433.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22Cl2N2OS/c1-22(2,3)13-7-8-14-16(12-25)21(28-19(14)11-13)26-20(27)10-9-15-17(23)5-4-6-18(15)24/h4-6,9-10,13H,7-8,11H2,1-3H3,(H,26,27)/b10-9+InChIKey
AEFNJFRNTLIMGK-MDZDMXLPSA-NSynonyms
544424-24-0(2E)N(6tertbutyl3cyano4567tetrahydro1benzothiophen2yl)3(26dichlorophenyl)prop2enamide
(E)N(6tertbutyl3cyano4567tetrahydro1benzothiophen2yl)3(26dichlorophenyl)prop2enamide
544424240
CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)C=CC3=C(C=CC=C3Cl)Cl
InChI=1SC22H22Cl2N2OSc122(23)13781416(1225)21(2819(14)1113)2620(27)1091517(23)54618(15)24h4691013H7811H213H3(H2627)b109+
MFCD02055096
N#Cc1c(NC(=O)C=Cc2c(Cl)cccc2Cl)sc2c1CCC(C2)C(C)(C)C
ZINC000002750878
ZINC000002750880
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