Vitas-M small molecule compound
(2E)-1-{5-[(3,4-dimethoxybenzyl)amino]-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl}-3-phenylprop-2-en-1-one
Catalog ID
STK227671
SMILES COc1ccc(cc1OC)CNc1nc(nn1C(=O)/C=C/c1ccccc1)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/c1-32-21-12-10-19(15-22(21)33-2)16-27-25-28-24(20-9-6-14-26-17-20)29-30(25)23(31)13-11-18-7-4-3-5-8-18/h3-15,17H,16H2,1-2H3,(H,27,28,29)/b13-11+InChIKey
HXVWYELCXSCWHD-ACCUITESSA-NSynonyms
(2E)1(5((34DIMETHOXYBENZYL)AMINO)3(PYRIDIN3YL)1H124TRIAZOL1YL)3PHENYLPROP2EN1ONE
(E)1(5((34dimethoxyphenyl)methylamino)3pyridin3yl124triazol1yl)3phenylprop2en1one
COC1=C(C=C(C=C1)CNC2=NC(=NN2C(=O)C=CC3=CC=CC=C3)C4=CN=CC=C4)OC
COc1ccc(cc1OC)CNc1nc(nn1C(=O)C=Cc1ccccc1)c1cccnc1
InChI=1SC25H23N5O3c13221121019(1522(21)332)1627252824(209614261720)2930(25)23(31)1311187435818h31517H16H212H3(H272829)b1311+
MFCD08671759
ZINC000009288889
ZINC09288889
ZINC9288889
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