Vitas-M small molecule compound

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

Catalog ID
STL019949
SMILES CCOC(=O)c1cc(sc1NC(=O)CC1Sc2ccccc2NC1=O)CC

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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/c1-3-11-9-12(19(24)25-4-2)18(26-11)21-16(22)10-15-17(23)20-13-7-5-6-8-14(13)27-15/h5-9,15H,3-4,10H2,1-2H3,(H,20,23)(H,21,22)
InChIKey
MECSUGCYKOEZDW-UHFFFAOYSA-N
Synonyms
405924-83-6
405924836
CCC1=CC(=C(S1)NC(=O)CC2C(=O)NC3=CC=CC=C3S2)C(=O)OCC
ETHYL5ETHYL2((((2R)3OXO34DIHYDRO2H14BENZOTHIAZIN2YL)ACETYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL5ETHYL2((((2S)3OXO34DIHYDRO2H14BENZOTHIAZIN2YL)ACETYL)AMINO)THIOPHENE3CARBOXYLATE
ethyl5ethyl2(((3oxo34dihydro2H14benzothiazin2yl)acetyl)amino)thiophene3carboxylate
ETHYL5ETHYL2((2(3OXO4H14BENZOTHIAZIN2YL)ACETYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL5ETHYL2(2(3OXO(2H4HBENZO(E)14THIAZIN2YL))ACETYLAMINO)THIOPHENE3CARBOXYLATE
ETHYL5ETHYL2(2(3OXO34DIHYDRO2H14BENZOTHIAZIN2YL)ACETAMIDO)THIOPHENE3CARBOXYLATE
ETHYL5ETHYL2(2(3OXO34DIHYDRO2HBENZO(B)(14)THIAZIN2YL)ACETAMIDO)THIOPHENE3CARBOXYLATE
InChI=1SC19H20N2O4S2c1311912(19(24)2542)18(2611)2116(22)101517(23)2013756814(13)2715h5915H3410H212H3(H2023)(H2122)
MFCD02071954
ZINC000000916799
ZINC000000916800

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Available files

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