Vitas-M small molecule compound

N-(4-chlorobenzyl)-2-(4-chloro-3-methylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)propanamide

Catalog ID
STK800432
SMILES Clc1ccc(cc1)CN(C(=O)C(Oc1ccc(c(c1)C)Cl)C)C1CCS(=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 C21H23Cl2NO4S MW 456.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23Cl2NO4S/c1-14-11-19(7-8-20(14)23)28-15(2)21(25)24(18-9-10-29(26,27)13-18)12-16-3-5-17(22)6-4-16/h3-8,11,15,18H,9-10,12-13H2,1-2H3
InChIKey
JULYUQMAITWJJG-UHFFFAOYSA-N
Synonyms
620557-61-1
(2R)N(4CHLOROBENZYL)2(4CHLORO3METHYLPHENOXY)N((3R)11DIOXIDOTETRAHYDROTHIOPHEN3YL)PROPANAMIDE
(2S)N(4CHLOROBENZYL)2(4CHLORO3METHYLPHENOXY)N((3R)11DIOXIDOTETRAHYDROTHIOPHEN3YL)PROPANAMIDE
2(4CHLORO3METHYLPHENOXY)N((4CHLOROPHENYL)METHYL)N(11DIOXOTHIOLAN3YL)PROPANAMIDE
2(4chloro3methylphenoxy)N(4chlorobenzyl)N(11dioxidotetrahydrothiophen3yl)propanamide
620557611
CC1=C(C=CC(=C1)OC(C)C(=O)N(CC2=CC=C(C=C2)Cl)C3CCS(=O)(=O)C3)Cl
InChI=1SC21H23Cl2NO4Sc1141119(7820(14)23)2815(2)21(25)24(1891029(2627)1318)12163517(22)6416h38111518H9101213H212H3
MFCD04011149
N(4chlorobenzyl)2(4chloro3methylphenoxy)N(11dioxidotetrahydrothiophen3yl)propanamide
ZINC000002373736
ZINC000013510994

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Available files

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