Vitas-M small molecule compound
1-{5-[2-(benzyloxy)-3-ethoxyphenyl]-4-(3-methylphenyl)-1-(4-methylphenyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl}ethanone
Catalog ID
STK510724
SMILES CCOc1cccc(c1OCc1ccccc1)C1N(N=C(N1c1cccc(c1)C)C(=O)C)c1ccc(cc1)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 C33H33N3O3 MW 519.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33N3O3/c1-5-38-30-16-10-15-29(31(30)39-22-26-12-7-6-8-13-26)33-35(28-14-9-11-24(3)21-28)32(25(4)37)34-36(33)27-19-17-23(2)18-20-27/h6-21,33H,5,22H2,1-4H3InChIKey
OXEBRZFBIUMPIL-UHFFFAOYSA-NSynonyms
1(3(3ETHOXY2PHENYLMETHOXYPHENYL)4(3METHYLPHENYL)2(4METHYLPHENYL)3H124TRIAZOL5YL)ETHANONE
1(5(2(benzyloxy)3ethoxyphenyl)4(3methylphenyl)1(4methylphenyl)45dihydro1H124triazol3yl)ethanone
CCOC1=CC=CC(=C1OCC2=CC=CC=C2)C3N(N=C(N3C4=CC=CC(=C4)C)C(=O)C)C5=CC=C(C=C5)C
InChI=1SC33H33N3O3c15383016101529(31(30)392226127681326)3335(281491124(3)2128)32(25(4)37)3436(33)27191723(2)182027h62133H522H214H3
MFCD02623365
ZINC000002137929
ZINC000002137931
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