Vitas-M small molecule compound

ethyl 2-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino}-4,5-dimethylthiophene-3-carboxylate

Catalog ID
STK415389
SMILES CCOC(=O)c1c(NC(=O)CSc2nc3c(s2)cccc3)sc(c1C)C

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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 C18H18N2O3S3 MW 406.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O3S3/c1-4-23-17(22)15-10(2)11(3)25-16(15)20-14(21)9-24-18-19-12-7-5-6-8-13(12)26-18/h5-8H,4,9H2,1-3H3,(H,20,21)
InChIKey
DSCRJHHTHYQEDM-UHFFFAOYSA-N
Synonyms
497867-94-4
497867944
CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CSC2=NC3=CC=CC=C3S2
ethyl2(((13benzothiazol2ylsulfanyl)acetyl)amino)45dimethylthiophene3carboxylate
ETHYL2(((13BENZOTHIAZOL2YLTHIO)ACETYL)AMINO)45DIMETHYL3THIOPHENECARBOXYLATE
ETHYL2((2(13BENZOTHIAZOL2YLSULFANYL)ACETYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
ETHYL2(2(BENZO(D)THIAZOL2YLTHIO)ACETAMIDO)45DIMETHYLTHIOPHENE3CARBOXYLATE
ETHYL2(2BENZOTHIAZOL2YLTHIOACETYLAMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
InChI=1SC18H18N2O3S3c142317(22)1510(2)11(3)2516(15)2014(21)924181912756813(12)2618h58H49H213H3(H2021)
MFCD03301111
ZINC000001794952
ZINC01794952
ZINC1794952

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Available files

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