Vitas-M small molecule compound

diethyl [(1Z)-3-oxo-1-phenyl-2-[(phenylcarbonyl)amino]-3-{[2-(trifluoromethyl)phenyl]amino}prop-1-en-1-yl]phosphonate

Catalog ID
STK820840
SMILES CCOP(=O)(/C(=C(/C(=O)Nc1ccccc1C(F)(F)F)\NC(=O)c1ccccc1)/c1ccccc1)OCC

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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 C27H26F3N2O5P MW 546.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26F3N2O5P/c1-3-36-38(35,37-4-2)24(19-13-7-5-8-14-19)23(32-25(33)20-15-9-6-10-16-20)26(34)31-22-18-12-11-17-21(22)27(28,29)30/h5-18H,3-4H2,1-2H3,(H,31,34)(H,32,33)/b24-23-
InChIKey
LTMBMIGJCJDSOT-VHXPQNKSSA-N
Synonyms

(2Z)3(DIETHOXYCARBONYL)3PHENYL2(PHENYLCARBONYLAMINO)N(2(TRIFLUOROMETHYL)PHENYL)PROP2ENAMIDE
(Z)diethyl(2benzamido3oxo1phenyl3((2(trifluoromethyl)phenyl)amino)prop1en1yl)phosphonate
CCOP(=O)(C(=C(C(=O)NC1=CC=CC=C1C(F)(F)F)NC(=O)C2=CC=CC=C2)C3=CC=CC=C3)OCC
CCOP(=O)(C(=C(C(=O)Nc1ccccc1C(F)(F)F)NC(=O)c1ccccc1)c1ccccc1)OCC
diethyl((1Z)3oxo1phenyl2((phenylcarbonyl)amino)3((2(trifluoromethyl)phenyl)amino)prop1en1yl)phosphonate
InChI=1SC27H26F3N2O5Pc133638(353742)24(19137581419)23(3225(33)201596101620)26(34)31221812111721(22)27(2829)30h518H34H212H3(H3134)(H3233)b2423
MFCD01459712
N((Z)1DIETHOXYPHOSPHORYL3OXO1PHENYL3(2(TRIFLUOROMETHYL)ANILINO)PROP1EN2YL)BENZAMIDE
ZINC000059821267
ZINC59821267

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Available files

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