Vitas-M small molecule compound
4-[({(2Z)-3-ethyl-2-[(4-methoxyphenyl)imino]-4-oxo-1,3-thiazinan-6-yl}carbonyl)amino]benzoic acid
Catalog ID
STK025884
SMILES COc1ccc(cc1)/N=C/1\SC(CC(=O)N1CC)C(=O)Nc1ccc(cc1)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 C21H21N3O5S MW 427.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O5S/c1-3-24-18(25)12-17(19(26)22-14-6-4-13(5-7-14)20(27)28)30-21(24)23-15-8-10-16(29-2)11-9-15/h4-11,17H,3,12H2,1-2H3,(H,22,26)(H,27,28)/b23-21-InChIKey
CICDJZHTQSWWOA-LNVKXUELSA-NSynonyms
442554-80-5(Z)4(3ethyl2((4methoxyphenyl)imino)4oxo13thiazinane6carboxamido)benzoicacid
4((((2Z)3ethyl2((4methoxyphenyl)imino)4oxo13thiazinan6yl)carbonyl)amino)benzoicacid
442554805
COc1ccc(cc1)N=C1SC(CC(=O)N1CC)C(=O)Nc1ccc(cc1)C(=O)O
MFCD02146686
STK025884
ZINC000008397083
ZINC000013424093
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