Vitas-M small molecule compound

N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(2,4-dichlorophenoxy)butanamide

Catalog ID
STK425996
SMILES N#Cc1c(NC(=O)CCCOc2ccc(cc2Cl)Cl)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 C23H26Cl2N2O2S MW 465.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26Cl2N2O2S/c1-23(2,3)14-6-8-16-17(13-26)22(30-20(16)11-14)27-21(28)5-4-10-29-19-9-7-15(24)12-18(19)25/h7,9,12,14H,4-6,8,10-11H2,1-3H3,(H,27,28)
InChIKey
PXISIDDUYFIIDA-UHFFFAOYSA-N
Synonyms

CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl
InChI=1SC23H26Cl2N2O2Sc123(23)14681617(1326)22(3020(16)1114)2721(28)541029199715(24)1218(19)25h791214H4681011H213H3(H2728)
MFCD01337017
N(6tertbutyl3cyano4567tetrahydro1benzothiophen2yl)4(24dichlorophenoxy)butanamide
ZINC000002736337
ZINC000002736338

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.