Vitas-M small molecule compound

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

Catalog ID
STK988529
SMILES CCCc1cc(c(s1)NC(=O)CC1Sc2ccccc2NC1=O)C(=O)OC

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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/c1-3-6-11-9-12(19(24)25-2)18(26-11)21-16(22)10-15-17(23)20-13-7-4-5-8-14(13)27-15/h4-5,7-9,15H,3,6,10H2,1-2H3,(H,20,23)(H,21,22)
InChIKey
GTJJTWDRFHKRIJ-UHFFFAOYSA-N
Synonyms
1017661-65-2
1017661652
CCCC1=CC(=C(S1)NC(=O)CC2C(=O)NC3=CC=CC=C3S2)C(=O)OC
InChI=1SC19H20N2O4S2c13611912(19(24)252)18(2611)2116(22)101517(23)2013745814(13)2715h457915H3610H212H3(H2023)(H2122)
methyl2(((3oxo34dihydro2H14benzothiazin2yl)acetyl)amino)5propylthiophene3carboxylate
methyl2((2(3oxo4H14benzothiazin2yl)acetyl)amino)5propylthiophene3carboxylate
METHYL2(2(3OXO(2H4HBENZO(E)14THIAZAPERHYDROIN2YL))ACETYLAMINO)5PROPYLTHIOPHENE3CARBOXYLATE
METHYL2(2(3OXO34DIHYDRO2HBENZO(B)(14)THIAZIN2YL)ACETAMIDO)5PROPYLTHIOPHENE3CARBOXYLATE
MFCD06420713
ZINC000016839377
ZINC000016839379

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Available files

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