Vitas-M small molecule compound
(2Z)-3-(1,3-benzodioxol-5-ylmethyl)-N-(4-ethoxyphenyl)-2-[(4-ethoxyphenyl)imino]-4-oxo-1,3-thiazinane-6-carboxamide
Catalog ID
STK113147
SMILES CCOc1ccc(cc1)NC(=O)C1CC(=O)N(/C(=N/c2ccc(cc2)OCC)/S1)Cc1ccc2c(c1)OCO2
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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 C29H29N3O6S MW 547.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N3O6S/c1-3-35-22-10-6-20(7-11-22)30-28(34)26-16-27(33)32(17-19-5-14-24-25(15-19)38-18-37-24)29(39-26)31-21-8-12-23(13-9-21)36-4-2/h5-15,26H,3-4,16-18H2,1-2H3,(H,30,34)/b31-29-InChIKey
BDCXYTKFWFQHPQ-YCNYHXFESA-NSynonyms
587849-95-4(2Z)3(13benzodioxol5ylmethyl)N(4ethoxyphenyl)2((4ethoxyphenyl)imino)4oxo13thiazinane6carboxamide
(Z)3(benzo(d)(13)dioxol5ylmethyl)N(4ethoxyphenyl)2((4ethoxyphenyl)imino)4oxo13thiazinane6carboxamide
587849954
CCOc1ccc(cc1)NC(=O)C1CC(=O)N(C(=Nc2ccc(cc2)OCC)S1)Cc1ccc2c(c1)OCO2
MFCD03676111
ZINC000100964520
ZINC000100964525
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