Vitas-M small molecule compound

N-(4-hydroxytetrahydrothiophen-3-yl)-2-[(5Z)-5-(2-methoxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]acetamide

Catalog ID
STL307765
SMILES COc1ccccc1/C=C/1\SC(=O)N(C1=O)CC(=O)NC1CSCC1O

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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 C17H18N2O5S2 MW 394.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O5S2/c1-24-13-5-3-2-4-10(13)6-14-16(22)19(17(23)26-14)7-15(21)18-11-8-25-9-12(11)20/h2-6,11-12,20H,7-9H2,1H3,(H,18,21)/b14-6-
InChIKey
MVOFDKLKRMOEGL-NSIKDUERSA-N
Synonyms

COC1=CC=CC=C1C=C2C(=O)N(C(=O)S2)CC(=O)NC3CSCC3O
COc1ccccc1C=C1SC(=O)N(C1=O)CC(=O)N(C@@H)1CSC(C@@H)1O
COc1ccccc1C=C1SC(=O)N(C1=O)CC(=O)NC1CSCC1O
InChI=1SC17H18N2O5S2c12413532410(13)61416(22)19(17(23)2614)715(21)1811825912(11)20h26111220H79H21H3(H1821)b146
MFCD28025034
N((3S4R)4hydroxytetrahydrothiophen3yl)2((E)5(2methoxybenzylidene)24dioxothiazolidin3yl)acetamide
N(4hydroxytetrahydrothiophen3yl)2((5Z)5(2methoxybenzylidene)24dioxo13thiazolidin3yl)acetamide
N(4hydroxythiolan3yl)2((5Z)5((2methoxyphenyl)methylidene)24dioxo13thiazolidin3yl)acetamide
N(4HYDROXYTHIOLAN3YL)2(5((2METHOXYPHENYL)METHYLENE)24DIOXO(13THIAZOLIDIN3YL))ACETAMIDE
ZINC000054360906
ZINC000054360909

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Available files

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