Vitas-M small molecule compound

2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-[4-(propan-2-yl)benzyl]propanamide

Catalog ID
STK817906
SMILES O=C(N(C1CCS(=O)(=O)C1)Cc1ccc(cc1)C(C)C)C(Oc1cc(C)c(c(c1)C)Cl)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 C25H32ClNO4S MW 478.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32ClNO4S/c1-16(2)21-8-6-20(7-9-21)14-27(22-10-11-32(29,30)15-22)25(28)19(5)31-23-12-17(3)24(26)18(4)13-23/h6-9,12-13,16,19,22H,10-11,14-15H2,1-5H3
InChIKey
LCEXKUNHOUFSTD-UHFFFAOYSA-N
Synonyms
579443-55-3
(2R)2(4CHLORO35DIMETHYLPHENOXY)N((3R)11DIOXIDOTETRAHYDROTHIOPHEN3YL)N(4(PROPAN2YL)BENZYL)PROPANAMIDE
2(4CHLORO35DIMETHYLPHENOXY)N(11DIOXIDOTETRAHYDROTHIOPHEN3YL)N(4(1METHYLETHYL)BENZYL)PROPANAMIDE
2(4chloro35dimethylphenoxy)N(11dioxidotetrahydrothiophen3yl)N(4(propan2yl)benzyl)propanamide
2(4chloro35dimethylphenoxy)N(11dioxidotetrahydrothiophen3yl)N(4isopropylbenzyl)propanamide
2(4CHLORO35DIMETHYLPHENOXY)N(11DIOXOTHIOLAN3YL)N((4PROPAN2YLPHENYL)METHYL)PROPANAMIDE
579443553
CC1=CC(=CC(=C1Cl)C)OC(C)C(=O)N(CC2=CC=C(C=C2)C(C)C)C3CCS(=O)(=O)C3
InChI=1SC25H32ClNO4Sc116(2)218620(7921)1427(22101132(2930)1522)25(28)19(5)31231217(3)24(26)18(4)1323h691213161922H10111415H215H3
MFCD04032819
N(11DIOXOTHIOLAN3YL)2(4CHLORO35DIMETHYLPHENOXY)N((4(METHYLETHYL)PHENYL)METHYL)PROPANAMIDE
ZINC000002396280
ZINC000009191210

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Available files

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