Vitas-M small molecule compound
2-({5-[(2,6-dimethylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(4-methoxyphenyl)ethanone
Catalog ID
STK218927
SMILES COc1ccc(cc1)C(=O)CSc1nnc(n1c1ccccc1)COc1c(C)cccc1C
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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 C26H25N3O3S MW 459.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O3S/c1-18-8-7-9-19(2)25(18)32-16-24-27-28-26(29(24)21-10-5-4-6-11-21)33-17-23(30)20-12-14-22(31-3)15-13-20/h4-15H,16-17H2,1-3H3InChIKey
XDEUJFUZJFZOAI-UHFFFAOYSA-NSynonyms
2((5((26DIMETHYLPHENOXY)METHYL)4PHENYL124TRIAZOL3YL)SULFANYL)1(4METHOXYPHENYL)ETHANONE
2((5((26DIMETHYLPHENOXY)METHYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)1(4METHOXYPHENYL)ETHANONE
CC1=C(C(=CC=C1)C)OCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)C4=CC=C(C=C4)OC
InChI=1SC26H25N3O3Sc11887919(2)25(18)321624272826(29(24)21105461121)331723(30)20121422(313)151320h415H1617H213H3
MFCD06000318
ZINC000001074790
ZINC01074790
ZINC1074790
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