Vitas-M small molecule compound

1-(4-methoxyphenyl)-2-({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)ethanone

Catalog ID
STK590603
SMILES COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)OC)nnc1COc1ccc(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 C26H25N3O4S MW 475.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O4S/c1-18-4-10-23(11-5-18)33-16-25-27-28-26(29(25)20-8-14-22(32-3)15-9-20)34-17-24(30)19-6-12-21(31-2)13-7-19/h4-15H,16-17H2,1-3H3
InChIKey
AGAFWOMNDJKOSG-UHFFFAOYSA-N
Synonyms
849016-84-8
1(4METHOXYPHENYL)2((4(4METHOXYPHENYL)5((4METHYLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYL)ETHANONE
1(4methoxyphenyl)2((4(4methoxyphenyl)5((4methylphenoxy)methyl)4H124triazol3yl)sulfanyl)ethanone
1(4methoxyphenyl)2((4(4methoxyphenyl)5((ptolyloxy)methyl)4H124triazol3yl)thio)ethanone
1(4METHOXYPHENYL)2((4(4METHOXYPHENYL)5(4METHYLPHENOXYMETHYL)4H124TRIAZOL3YL)SULFANYL)ETHAN1ONE
1(4METHOXYPHENYL)2(4(4METHOXYPHENYL)5((4METHYLPHENOXY)METHYL)(124TRIAZOL3YLTHIO))ETHAN1ONE
849016848
CC1=CC=C(C=C1)OCC2=NN=C(N2C3=CC=C(C=C3)OC)SCC(=O)C4=CC=C(C=C4)OC
InChI=1SC26H25N3O4Sc11841023(11518)331625272826(29(25)2081422(323)15920)341724(30)1961221(312)13719h415H1617H213H3
MFCD05680734
ZINC000002451868
ZINC02451868
ZINC2451868

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.