Vitas-M small molecule compound

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide

Catalog ID
STL054938
SMILES COc1ccc(cc1)n1c(SCC(=O)Nc2ccc3c(c2)OCCO3)nnc1COc1ccc(cc1)C

Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.

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 C27H26N4O5S MW 518.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O5S/c1-18-3-8-22(9-4-18)36-16-25-29-30-27(31(25)20-6-10-21(33-2)11-7-20)37-17-26(32)28-19-5-12-23-24(15-19)35-14-13-34-23/h3-12,15H,13-14,16-17H2,1-2H3,(H,28,32)
InChIKey
GUEROOPYNWBSKO-UHFFFAOYSA-N
Synonyms
848992-58-5
848992585
CC1=CC=C(C=C1)OCC2=NN=C(N2C3=CC=C(C=C3)OC)SCC(=O)NC4=CC5=C(C=C4)OCCO5
InChI=1SC27H26N4O5Sc1183822(9418)361625293027(31(25)2061021(332)11720)371726(32)28195122324(1519)3514133423h31215H13141617H212H3(H2832)
MFCD05679111
N(23DIHYDRO14BENZODIOXIN6YL)2((4(4METHOXYPHENYL)5((4METHYLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(23dihydro14benzodioxin6yl)2((4(4methoxyphenyl)5((4methylphenoxy)methyl)4H124triazol3yl)sulfanyl)acetamide
N(23DIHYDRO14BENZODIOXIN6YL)2((4(4METHOXYPHENYL)5(4METHYLPHENOXYMETHYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(23dihydrobenzo(b)(14)dioxin6yl)2((4(4methoxyphenyl)5((ptolyloxy)methyl)4H124triazol3yl)thio)acetamide
N(2H3HBENZO(34E)14DIOXIN6YL)2(4(4METHOXYPHENYL)5((4METHYLPHENOXY)METHYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000002447000
ZINC02447000
ZINC2447000

Check stock

See real-time availability and sample size for STL054938 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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