Vitas-M small molecule compound

ethyl 4,5-dimethyl-2-{[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl)acetyl]amino}thiophene-3-carboxylate

Catalog ID
STK951586
SMILES CCOC(=O)c1c(NC(=O)CC2Sc3ccccc3NC2=O)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 C19H20N2O4S2 MW 404.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O4S2/c1-4-25-19(24)16-10(2)11(3)26-18(16)21-15(22)9-14-17(23)20-12-7-5-6-8-13(12)27-14/h5-8,14H,4,9H2,1-3H3,(H,20,23)(H,21,22)
InChIKey
HHAHVKRASNUOMG-UHFFFAOYSA-N
Synonyms
302804-36-0
302804360
CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CC2C(=O)NC3=CC=CC=C3S2
ethyl45dimethyl2(((3oxo34dihydro2H14benzothiazin2yl)acetyl)amino)thiophene3carboxylate
ETHYL45DIMETHYL2((2(3OXO4H14BENZOTHIAZIN2YL)ACETYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL45DIMETHYL2(2(3OXO(2H4HBENZO(E)14THIAZIN2YL))ACETYLAMINO)THIOPHENE3CARBOXYLATE
ETHYL45DIMETHYL2(2(3OXO34DIHYDRO2H14BENZOTHIAZIN2YL)ACETAMIDO)THIOPHENE3CARBOXYLATE
ETHYL45DIMETHYL2(2(3OXO34DIHYDRO2HBENZO(B)(14)THIAZIN2YL)ACETAMIDO)THIOPHENE3CARBOXYLATE
InChI=1SC19H20N2O4S2c142519(24)1610(2)11(3)2618(16)2115(22)91417(23)2012756813(12)2714h5814H49H213H3(H2023)(H2122)
MFCD01848149
ZINC000000639819
ZINC000000639823

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Available files

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