Vitas-M small molecule compound
ethyl [(3E)-3-benzylidene-1,1-dioxido-4-oxo-3,4-dihydro-2H-1,2-benzothiazin-2-yl]acetate
Catalog ID
STL441435
SMILES CCOC(=O)CN1/C(=C/c2ccccc2)/C(=O)c2c(S1(=O)=O)cccc2
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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 C19H17NO5S MW 371.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17NO5S/c1-2-25-18(21)13-20-16(12-14-8-4-3-5-9-14)19(22)15-10-6-7-11-17(15)26(20,23)24/h3-12H,2,13H2,1H3/b16-12+InChIKey
WFBRGCCPMAEREM-FOWTUZBSSA-NSynonyms
CCOC(=O)CN1C(=CC2=CC=CC=C2)C(=O)C3=CC=CC=C3S1(=O)=O
CCOC(=O)CN1C(=Cc2ccccc2)C(=O)c2c(S1(=O)=O)cccc2
ethyl((3E)3benzylidene11dioxido4oxo34dihydro2H12benzothiazin2yl)acetate
ethyl2((3E)3benzylidene114trioxo1$l^(6)2benzothiazin2yl)acetate
InChI=1SC19H17NO5Sc122518(21)132016(12148435914)19(22)1510671117(15)26(2023)24h312H213H21H3b1612+
MFCD08060304
ZINC000005274934
ZINC5274934
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