Vitas-M small molecule compound

4-tert-butyl-N-{2,2,2-trichloro-1-[(1,1-dioxidotetrahydrothiophen-3-yl)amino]ethyl}benzamide

Catalog ID
STK809756
SMILES O=C(c1ccc(cc1)C(C)(C)C)NC(C(Cl)(Cl)Cl)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 C17H23Cl3N2O3S MW 441.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23Cl3N2O3S/c1-16(2,3)12-6-4-11(5-7-12)14(23)22-15(17(18,19)20)21-13-8-9-26(24,25)10-13/h4-7,13,15,21H,8-10H2,1-3H3,(H,22,23)
InChIKey
SJQAVUAUHVCSRI-UHFFFAOYSA-N
Synonyms

4tertbutylN(222trichloro1((11dioxidotetrahydrothiophen3yl)amino)ethyl)benzamide
4TERTBUTYLN(222TRICHLORO1((11DIOXOTHIOLAN3YL)AMINO)ETHYL)BENZAMIDE
CC(C)(C)C1=CC=C(C=C1)C(=O)NC(C(Cl)(Cl)Cl)NC2CCS(=O)(=O)C2
InChI=1SC17H23Cl3N2O3Sc116(23)126411(5712)14(23)2215(17(1819)20)21138926(2425)1013h47131521H810H213H3(H2223)
MFCD00620331
ZINC000016790952
ZINC000024302937

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Available files

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