Vitas-M small molecule compound

2-(3,4-dimethylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-ethylbenzyl)propanamide

Catalog ID
STK516701
SMILES CCc1ccc(cc1)CN(C(=O)C(Oc1ccc(c(c1)C)C)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 C24H31NO4S MW 429.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31NO4S/c1-5-20-7-9-21(10-8-20)15-25(22-12-13-30(27,28)16-22)24(26)19(4)29-23-11-6-17(2)18(3)14-23/h6-11,14,19,22H,5,12-13,15-16H2,1-4H3
InChIKey
QWKCNUFXNHPOQF-UHFFFAOYSA-N
Synonyms
579442-56-1
(2S)2(34DIMETHYLPHENOXY)N((3R)11DIOXIDOTETRAHYDROTHIOPHEN3YL)N(4ETHYLBENZYL)PROPANAMIDE
2(34DIMETHYLPHENOXY)N(11DIOXIDOTETRAHYDRO3THIENYL)N(4ETHYLBENZYL)PROPANAMIDE
2(34dimethylphenoxy)N(11dioxidotetrahydrothiophen3yl)N(4ethylbenzyl)propanamide
2(34DIMETHYLPHENOXY)N(11DIOXOTHIOLAN3YL)N((4ETHYLPHENYL)METHYL)PROPANAMIDE
579442561
CCC1=CC=C(C=C1)CN(C2CCS(=O)(=O)C2)C(=O)C(C)OC3=CC(=C(C=C3)C)C
InChI=1SC24H31NO4Sc15207921(10820)1525(22121330(2728)1622)24(26)19(4)292311617(2)18(3)1423h611141922H512131516H214H3
MFCD04032730
ZINC000002348631
ZINC000005443073

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Available files

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