Vitas-M small molecule compound
ethyl 2-{[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL020136
SMILES CCOC(=O)c1c(NC(=O)CC2Sc3ccccc3NC2=O)sc2c1CCCC2
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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 C21H22N2O4S2 MW 430.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O4S2/c1-2-27-21(26)18-12-7-3-5-9-14(12)29-20(18)23-17(24)11-16-19(25)22-13-8-4-6-10-15(13)28-16/h4,6,8,10,16H,2-3,5,7,9,11H2,1H3,(H,22,25)(H,23,24)InChIKey
SQGSBQLWMPEJMP-UHFFFAOYSA-NSynonyms
302552-49-4302552494
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CC3C(=O)NC4=CC=CC=C4S3
ethyl2(((3oxo34dihydro2H14benzothiazin2yl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((2(3oxo4H14benzothiazin2yl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC21H22N2O4S2c122721(26)1812735914(12)2920(18)2317(24)111619(25)22138461015(13)2816h4681016H2357911H21H3(H2225)(H2324)
MFCD01817580
ZINC000000623626
ZINC000000623628
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