Vitas-M small molecule compound

(2Z)-3-benzyl-N-(3-ethoxyphenyl)-4-oxo-2-{[4-(trifluoromethyl)phenyl]imino}-1,3-thiazinane-6-carboxamide

Catalog ID
STK112634
SMILES CCOc1cccc(c1)NC(=O)C1CC(=O)N(/C(=N/c2ccc(cc2)C(F)(F)F)/S1)Cc1ccccc1

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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 C27H24F3N3O3S MW 527.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24F3N3O3S/c1-2-36-22-10-6-9-21(15-22)31-25(35)23-16-24(34)33(17-18-7-4-3-5-8-18)26(37-23)32-20-13-11-19(12-14-20)27(28,29)30/h3-15,23H,2,16-17H2,1H3,(H,31,35)/b32-26-
InChIKey
VGZTTXHEWSSRLT-FSRJSHLRSA-N
Synonyms
587849-37-4
(2Z)3benzylN(3ethoxyphenyl)4oxo2((4(trifluoromethyl)phenyl)imino)13thiazinane6carboxamide
(Z)3benzylN(3ethoxyphenyl)4oxo2((4(trifluoromethyl)phenyl)imino)13thiazinane6carboxamide
587849374
CCOc1cccc(c1)NC(=O)C1CC(=O)N(C(=Nc2ccc(cc2)C(F)(F)F)S1)Cc1ccccc1
MFCD03679557
ZINC000100144031
ZINC000100144035

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.