Vitas-M small molecule compound

N-(1,1-dioxidotetrahydrothiophen-3-yl)-3-methoxy-N-(3,4,5-trimethoxybenzyl)benzamide

Catalog ID
STK907960
SMILES COc1cccc(c1)C(=O)N(C1CCS(=O)(=O)C1)Cc1cc(OC)c(c(c1)OC)OC

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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 C22H27NO7S MW 449.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO7S/c1-27-18-7-5-6-16(12-18)22(24)23(17-8-9-31(25,26)14-17)13-15-10-19(28-2)21(30-4)20(11-15)29-3/h5-7,10-12,17H,8-9,13-14H2,1-4H3
InChIKey
QBAQAFGVMQVYKL-UHFFFAOYSA-N
Synonyms

COC1=CC=CC(=C1)C(=O)N(CC2=CC(=C(C(=C2)OC)OC)OC)C3CCS(=O)(=O)C3
InChI=1SC22H27NO7Sc1271875616(1218)22(24)23(178931(2526)1417)13151019(282)21(304)20(1115)293h57101217H891314H214H3
MFCD06647461
N(11dioxidotetrahydrothiophen3yl)3methoxyN(345trimethoxybenzyl)benzamide
N(11dioxothiolan3yl)3methoxyN((345trimethoxyphenyl)methyl)benzamide
ZINC000016751891
ZINC000016751894

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Available files

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