Vitas-M small molecule compound
2,5-dichloro-N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide
Catalog ID
STK421695
SMILES CCC(C1CCc2c(C1)sc(c2C#N)NC(=O)c1cc(Cl)ccc1Cl)(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 C21H22Cl2N2OS MW 421.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22Cl2N2OS/c1-4-21(2,3)12-5-7-14-16(11-24)20(27-18(14)9-12)25-19(26)15-10-13(22)6-8-17(15)23/h6,8,10,12H,4-5,7,9H2,1-3H3,(H,25,26)InChIKey
BXSFWGLPOQRRKM-UHFFFAOYSA-NSynonyms
313386-19-525dichloroN(3cyano6(2methylbutan2yl)4567tetrahydro1benzothiophen2yl)benzamide
313386195
CCC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=C(C=CC(=C3)Cl)Cl
InChI=1SC21H22Cl2N2OSc1421(23)12571416(1124)20(2718(14)912)2519(26)151013(22)6817(15)23h681012H4579H213H3(H2526)
MFCD01336392
ZINC000002092912
ZINC000002092914
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