Vitas-M small molecule compound
(2E)-1-{5-[(2-methoxybenzyl)amino]-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl}-3-(2-methoxyphenyl)prop-2-en-1-one
Catalog ID
STK227732
SMILES COc1ccccc1CNc1nc(nn1C(=O)/C=C/c1ccccc1OC)c1cccnc1
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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 C25H23N5O3 MW 441.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5O3/c1-32-21-11-5-3-8-18(21)13-14-23(31)30-25(27-17-19-9-4-6-12-22(19)33-2)28-24(29-30)20-10-7-15-26-16-20/h3-16H,17H2,1-2H3,(H,27,28,29)/b14-13+InChIKey
PPYMAQBHYGFVRB-BUHFOSPRSA-NSynonyms
(2E)1(5((2METHOXYBENZYL)AMINO)3(PYRIDIN3YL)1H124TRIAZOL1YL)3(2METHOXYPHENYL)PROP2EN1ONE
(E)3(2methoxyphenyl)1(5((2methoxyphenyl)methylamino)3pyridin3yl124triazol1yl)prop2en1one
COC1=CC=CC=C1CNC2=NC(=NN2C(=O)C=CC3=CC=CC=C3OC)C4=CN=CC=C4
COc1ccccc1CNc1nc(nn1C(=O)C=Cc1ccccc1OC)c1cccnc1
InChI=1SC25H23N5O3c132211153818(21)131423(31)3025(2717199461222(19)332)2824(2930)2010715261620h316H17H212H3(H272829)b1413+
MFCD08671803
ZINC000009288944
ZINC09288944
ZINC9288944
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