Vitas-M small molecule compound
(2E)-1-{3,5-bis[(3-methoxybenzyl)amino]-1H-1,2,4-triazol-1-yl}-3-(4-fluorophenyl)prop-2-en-1-one
Catalog ID
STK178854
SMILES COc1cccc(c1)CNc1nc(nn1C(=O)/C=C/c1ccc(cc1)F)NCc1cccc(c1)OC
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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 C27H26FN5O3 MW 487.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26FN5O3/c1-35-23-7-3-5-20(15-23)17-29-26-31-27(30-18-21-6-4-8-24(16-21)36-2)33(32-26)25(34)14-11-19-9-12-22(28)13-10-19/h3-16H,17-18H2,1-2H3,(H2,29,30,31,32)/b14-11+InChIKey
ILZDDFRMESXMND-SDNWHVSQSA-NSynonyms
(2E)1(35BIS((3METHOXYBENZYL)AMINO)1H124TRIAZOL1YL)3(4FLUOROPHENYL)PROP2EN1ONE(E)1(35bis((3methoxyphenyl)methylamino)124triazol1yl)3(4fluorophenyl)prop2en1one
COC1=CC=CC(=C1)CNC2=NN(C(=N2)NCC3=CC(=CC=C3)OC)C(=O)C=CC4=CC=C(C=C4)F
COc1cccc(c1)CNc1nc(nn1C(=O)C=Cc1ccc(cc1)F)NCc1cccc(c1)OC
Registry IDs
MFCD06663928ZINC000009948491
ZINC09948491
ZINC9948491
Check stock
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Check stock on Vitas-MAvailable files
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