Vitas-M small molecule compound
3-[({(2Z)-2-[(4-ethoxyphenyl)imino]-3-ethyl-4-oxo-1,3-thiazinan-6-yl}carbonyl)amino]benzoic acid
Catalog ID
STL000074
SMILES CCOc1ccc(cc1)/N=C/1\SC(CC(=O)N1CC)C(=O)Nc1cccc(c1)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 C22H23N3O5S MW 441.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O5S/c1-3-25-19(26)13-18(20(27)23-16-7-5-6-14(12-16)21(28)29)31-22(25)24-15-8-10-17(11-9-15)30-4-2/h5-12,18H,3-4,13H2,1-2H3,(H,23,27)(H,28,29)/b24-22-InChIKey
TWSJJDSJOYUELN-GYHWCHFESA-NSynonyms
470447-78-0(Z)3(2((4ethoxyphenyl)imino)3ethyl4oxo13thiazinane6carboxamido)benzoicacid
3((((2Z)2((4ethoxyphenyl)imino)3ethyl4oxo13thiazinan6yl)carbonyl)amino)benzoicacid
470447780
CCOc1ccc(cc1)N=C1SC(CC(=O)N1CC)C(=O)Nc1cccc(c1)C(=O)O
MFCD02146712
ZINC000013423930
ZINC000013423931
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