Vitas-M small molecule compound

1-(4-methoxyphenyl)-N,4-diphenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide

Catalog ID
STL006043
SMILES COc1ccc(cc1)c1nn2c3n1CCCCc3c(c2C(=S)Nc1ccccc1)c1ccccc1

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 C29H26N4OS MW 478.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N4OS/c1-34-23-17-15-21(16-18-23)27-31-33-26(28(35)30-22-12-6-3-7-13-22)25(20-10-4-2-5-11-20)24-14-8-9-19-32(27)29(24)33/h2-7,10-13,15-18H,8-9,14,19H2,1H3,(H,30,35)
InChIKey
WBTVAHJESIBYOA-UHFFFAOYSA-N
Synonyms
540773-45-3
1(4methoxyphenyl)N4diphenyl5678tetrahydro22a8atriazacyclopenta(cd)azulene3carbothioamide
4(4methoxyphenyl)N1diphenyl5678tetrahydro2a34atriazacyclopenta(cd)azulene2carbothioamide
540773453
COC1=CC=C(C=C1)C2=NN3C(=C(C4=C3N2CCCC4)C5=CC=CC=C5)C(=S)NC6=CC=CC=C6
InChI=1SC29H26N4OSc13423171521(161823)27313326(28(35)3022126371322)25(20104251120)2414891932(27)29(24)33h2710131518H891419H21H3(H3035)
MFCD03460419
ZINC000002249566
ZINC02249566
ZINC2249566

Check stock

See real-time availability and sample size for STL006043 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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