Vitas-M small molecule compound

2-{[5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-[1-(2-methoxyethyl)-1H-indol-3-yl]ethanone

Catalog ID
STL406034
SMILES COCCn1cc(c2c1cccc2)C(=O)CSc1nnc(n1C)c1ccc2c(c1)OCCCO2

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 C25H26N4O4S MW 478.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O4S/c1-28-24(17-8-9-22-23(14-17)33-12-5-11-32-22)26-27-25(28)34-16-21(30)19-15-29(10-13-31-2)20-7-4-3-6-18(19)20/h3-4,6-9,14-15H,5,10-13,16H2,1-2H3
InChIKey
AWGLUPNRDFDUEN-UHFFFAOYSA-N
Synonyms

2((5(34dihydro2H15benzodioxepin7yl)4methyl124triazol3yl)sulfanyl)1(1(2methoxyethyl)indol3yl)ethanone
2((5(34dihydro2H15benzodioxepin7yl)4methyl4H124triazol3yl)sulfanyl)1(1(2methoxyethyl)1Hindol3yl)ethanone
CN1C(=NN=C1SCC(=O)C2=CN(C3=CC=CC=C32)CCOC)C4=CC5=C(C=C4)OCCCO5
InChI=1SC25H26N4O4Sc12824(17892223(1417)33125113222)262725(28)341621(30)191529(1013312)20743618(19)20h34691415H5101316H212H3
MFCD27220634
ZINC000021723219
ZINC21723219

Check stock

See real-time availability and sample size for STL406034 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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