Vitas-M small molecule compound

(2Z)-3-(4-chlorobenzyl)-2-{[4-(ethoxycarbonyl)phenyl]imino}-4-oxo-1,3-thiazinane-6-carboxylic acid

Catalog ID
STK098503
SMILES CCOC(=O)c1ccc(cc1)/N=C/1\SC(CC(=O)N1Cc1ccc(cc1)Cl)C(=O)O

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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 C21H19ClN2O5S MW 446.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN2O5S/c1-2-29-20(28)14-5-9-16(10-6-14)23-21-24(12-13-3-7-15(22)8-4-13)18(25)11-17(30-21)19(26)27/h3-10,17H,2,11-12H2,1H3,(H,26,27)/b23-21-
InChIKey
GJFWTCHUELGSKA-LNVKXUELSA-N
Synonyms
361995-39-3
(2Z)3(4chlorobenzyl)2((4(ethoxycarbonyl)phenyl)imino)4oxo13thiazinane6carboxylicacid
(Z)3(4chlorobenzyl)2((4(ethoxycarbonyl)phenyl)imino)4oxo13thiazinane6carboxylicacid
361995393
CCOC(=O)c1ccc(cc1)N=C1SC(CC(=O)N1Cc1ccc(cc1)Cl)C(=O)O
MFCD02648589
STK098503
ZINC000002316767
ZINC000013551380

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Available files

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