Vitas-M small molecule compound
propan-2-yl 2-{[(2E)-2-cyano-3-(4-methoxy-3-{[3-(trifluoromethyl)phenoxy]methyl}phenyl)prop-2-enoyl]amino}thiophene-3-carboxylate
Catalog ID
STK472706
SMILES N#C/C(=C\c1ccc(c(c1)COc1cccc(c1)C(F)(F)F)OC)/C(=O)Nc1sccc1C(=O)OC(C)C
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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 C27H23F3N2O5S MW 544.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23F3N2O5S/c1-16(2)37-26(34)22-9-10-38-25(22)32-24(33)18(14-31)11-17-7-8-23(35-3)19(12-17)15-36-21-6-4-5-20(13-21)27(28,29)30/h4-13,16H,15H2,1-3H3,(H,32,33)/b18-11+InChIKey
SCEWJGMSIMXOJK-WOJGMQOQSA-NSynonyms
CC(C)OC(=O)C1=C(SC=C1)NC(=O)C(=CC2=CC(=C(C=C2)OC)COC3=CC=CC(=C3)C(F)(F)F)C#N
InChI=1SC27H23F3N2O5Sc116(2)3726(34)229103825(22)3224(33)18(1431)11177823(353)19(1217)15362164520(1321)27(2829)30h41316H15H213H3(H3233)b1811+
METHYLETHYL2((2E)2CYANO3(4METHOXY3((3(TRIFLUOROMETHYL)PHENOXY)METHYL)PHENYL)PROP2ENOYLAMINO)THIOPHENE3CARBOXYLATE
MFCD07093364
N#CC(=Cc1ccc(c(c1)COc1cccc(c1)C(F)(F)F)OC)C(=O)Nc1sccc1C(=O)OC(C)C
propan2yl2(((2E)2cyano3(4methoxy3((3(trifluoromethyl)phenoxy)methyl)phenyl)prop2enoyl)amino)thiophene3carboxylate
propan2yl2(((E)2cyano3(4methoxy3((3(trifluoromethyl)phenoxy)methyl)phenyl)prop2enoyl)amino)thiophene3carboxylate
ZINC000097965805
ZINC97965805
Check stock
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Check stock on Vitas-MAvailable files
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