Vitas-M small molecule compound

3,5-dichloro-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(naphthalen-1-ylmethyl)-4-(pentyloxy)benzamide

Catalog ID
STK910909
SMILES CCCCCOc1c(Cl)cc(cc1Cl)C(=O)N(C1CCS(=O)(=O)C1)Cc1cccc2c1cccc2

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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 C27H29Cl2NO4S MW 534.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29Cl2NO4S/c1-2-3-6-13-34-26-24(28)15-21(16-25(26)29)27(31)30(22-12-14-35(32,33)18-22)17-20-10-7-9-19-8-4-5-11-23(19)20/h4-5,7-11,15-16,22H,2-3,6,12-14,17-18H2,1H3
InChIKey
URSMSAIEJNPUOS-UHFFFAOYSA-N
Synonyms

35dichloroN(11dioxidotetrahydrothiophen3yl)N(naphthalen1ylmethyl)4(pentyloxy)benzamide
35dichloroN(11dioxothiolan3yl)N(naphthalen1ylmethyl)4pentoxybenzamide
CCCCCOC1=C(C=C(C=C1Cl)C(=O)N(CC2=CC=CC3=CC=CC=C32)C4CCS(=O)(=O)C4)Cl
InChI=1SC27H29Cl2NO4Sc123613342624(28)1521(1625(26)29)27(31)30(22121435(3233)1822)17201079198451123(19)20h45711151622H23612141718H21H3
MFCD07425801
ZINC000098047999
ZINC000098048000

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Available files

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