Vitas-M small molecule compound

ethyl 6-{2-[(4-ethoxyphenyl)amino]-2-oxoethyl}-5-oxothiomorpholine-3-carboxylate

Catalog ID
STL018881
SMILES CCOC(=O)C1CSC(C(=O)N1)CC(=O)Nc1ccc(cc1)OCC

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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 C17H22N2O5S MW 366.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O5S/c1-3-23-12-7-5-11(6-8-12)18-15(20)9-14-16(21)19-13(10-25-14)17(22)24-4-2/h5-8,13-14H,3-4,9-10H2,1-2H3,(H,18,20)(H,19,21)
InChIKey
LGXVYMUFDRXPPG-UHFFFAOYSA-N
Synonyms
500002-62-0
500002620
5KETO6(2KETO2(PPHENETIDINO)ETHYL)THIOMORPHOLINE3CARBOXYLICACIDETHYLESTER
6((4ETHOXYPHENYLCARBAMOYL)METHYL)5OXOTHIOMORPHOLINE3CARBOXYLICACIDETHYLESTER
6(2(4ETHOXYANILINO)2OXOETHYL)5OXO3THIOMORPHOLINECARBOXYLICACIDETHYLESTER
CCOC1=CC=C(C=C1)NC(=O)CC2C(=O)NC(CS2)C(=O)OCC
ETHYL6(2((4ETHOXYPHENYL)AMINO)2OXIDANYLIDENEETHYL)5OXIDANYLIDENETHIOMORPHOLINE3CARBOXYLATE
ethyl6(2((4ethoxyphenyl)amino)2oxoethyl)5oxothiomorpholine3carboxylate
ETHYL6(2(4ETHOXYANILINO)2OXOETHYL)5OXOTHIOMORPHOLINE3CARBOXYLATE
InChI=1SC17H22N2O5Sc1323127511(6812)1815(20)91416(21)1913(102514)17(22)2442h581314H34910H212H3(H1820)(H1921)
MFCD01807098
ZINC000000851184
ZINC000000851187

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Available files

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