Vitas-M small molecule compound

N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-[(5Z)-5-(3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetamide

Catalog ID
STK607933
SMILES COc1cccc(c1)/C=C/1\SC(=S)N(C1=O)CC(=O)NC1CCS(=O)(=O)C1

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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 C17H18N2O5S3 MW 426.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O5S3/c1-24-13-4-2-3-11(7-13)8-14-16(21)19(17(25)26-14)9-15(20)18-12-5-6-27(22,23)10-12/h2-4,7-8,12H,5-6,9-10H2,1H3,(H,18,20)/b14-8-
InChIKey
QMYRYZWIJZGMPI-ZSOIEALJSA-N
Synonyms
892628-78-3
(Z)N(11dioxidotetrahydrothiophen3yl)2(5(3methoxybenzylidene)4oxo2thioxothiazolidin3yl)acetamide
892628783
COC1=CC=CC(=C1)C=C2C(=O)N(C(=S)S2)CC(=O)NC3CCS(=O)(=O)C3
COc1cccc(c1)C=C1SC(=S)N(C1=O)CC(=O)NC1CCS(=O)(=O)C1
InChI=1SC17H18N2O5S3c1241342311(713)81416(21)19(17(25)2614)915(20)18125627(2223)1012h247812H56910H21H3(H1820)b148
MFCD06793943
N(11dioxidotetrahydrothiophen3yl)2((5Z)5(3methoxybenzylidene)4oxo2thioxo13thiazolidin3yl)acetamide
N(11DIOXOTHIOLAN3YL)2((5Z)5((3METHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETAMIDE
N(11DIOXOTHIOLAN3YL)2(5((3METHOXYPHENYL)METHYLENE)4OXO2THIOXO(13THIAZOLIDIN3YL))ACETAMIDE
ZINC000008972192
ZINC000008972193

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Available files

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