Vitas-M small molecule compound

methyl 2-(morpholin-4-yl)-5-{[(phenylsulfanyl)acetyl]amino}benzoate

Catalog ID
STK729628
SMILES COC(=O)c1cc(ccc1N1CCOCC1)NC(=O)CSc1ccccc1

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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 C20H22N2O4S MW 386.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O4S/c1-25-20(24)17-13-15(7-8-18(17)22-9-11-26-12-10-22)21-19(23)14-27-16-5-3-2-4-6-16/h2-8,13H,9-12,14H2,1H3,(H,21,23)
InChIKey
SWHNIBMFPSIIFH-UHFFFAOYSA-N
Synonyms
1158490-20-0
1158490200
COC(=O)C1=C(C=CC(=C1)NC(=O)CSC2=CC=CC=C2)N3CCOCC3
InChI=1SC20H22N2O4Sc12520(24)171315(7818(17)2291126121022)2119(23)1427165324616h2813H91214H21H3(H2123)
methyl2(morpholin4yl)5(((phenylsulfanyl)acetyl)amino)benzoate
methyl2morpholin4yl5((2phenylsulfanylacetyl)amino)benzoate
methyl2morpholino5(2(phenylthio)acetamido)benzoate
MFCD13371782
ZINC000030826248
ZINC30826248

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Available files

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