Vitas-M small molecule compound
ethyl 2-{[3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)propanoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK132018
SMILES CCOC(=O)c1c(NC(=O)CCN2C(=O)c3c(S2(=O)=O)cccc3)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 C21H22N2O6S2 MW 462.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O6S2/c1-2-29-21(26)18-13-7-3-5-9-15(13)30-19(18)22-17(24)11-12-23-20(25)14-8-4-6-10-16(14)31(23,27)28/h4,6,8,10H,2-3,5,7,9,11-12H2,1H3,(H,22,24)InChIKey
MJGFANDBPWTNJN-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CCN3C(=O)C4=CC=CC=C4S3(=O)=O
ethyl2((3(11dioxido3oxo12benzothiazol2(3H)yl)propanoyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2(3(113trioxo12benzothiazol2yl)propanoylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC21H22N2O6S2c122921(26)1813735915(13)3019(18)2217(24)11122320(25)148461016(14)31(2327)28h46810H235791112H21H3(H2224)
MFCD05150188
ZINC000017083844
ZINC17083844
Check stock
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