Vitas-M small molecule compound
4-[({(2Z)-3-(1,3-benzodioxol-5-ylmethyl)-2-[(4-ethoxyphenyl)imino]-4-oxo-1,3-thiazinan-6-yl}carbonyl)amino]benzoic acid
Catalog ID
STL018844
SMILES CCOc1ccc(cc1)/N=C/1\SC(CC(=O)N1Cc1ccc2c(c1)OCO2)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 C28H25N3O7S MW 547.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O7S/c1-2-36-21-10-8-20(9-11-21)30-28-31(15-17-3-12-22-23(13-17)38-16-37-22)25(32)14-24(39-28)26(33)29-19-6-4-18(5-7-19)27(34)35/h3-13,24H,2,14-16H2,1H3,(H,29,33)(H,34,35)/b30-28-InChIKey
BNJIJDBYYNSOOH-HYOGKJQXSA-NSynonyms
442536-81-4(Z)4(3(benzo(d)(13)dioxol5ylmethyl)2((4ethoxyphenyl)imino)4oxo13thiazinane6carboxamido)benzoicacid
4((((2Z)3(13benzodioxol5ylmethyl)2((4ethoxyphenyl)imino)4oxo13thiazinan6yl)carbonyl)amino)benzoicacid
442536814
CCOc1ccc(cc1)N=C1SC(CC(=O)N1Cc1ccc2c(c1)OCO2)C(=O)Nc1ccc(cc1)C(=O)O
MFCD03057302
ZINC000100570935
ZINC000100570936
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