Vitas-M small molecule compound

1-[(4-bromobenzyl)sulfanyl]-4-(furan-2-ylmethyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one

Catalog ID
STK531599
SMILES Brc1ccc(cc1)CSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2Cc1ccco1)CCCCC3

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 C30H27BrN4O2S MW 587.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27BrN4O2S/c31-22-12-10-20(11-13-22)19-38-29-33-32-28-34(18-23-8-6-16-37-23)27(36)25-26(35(28)29)24-9-3-2-7-21(24)17-30(25)14-4-1-5-15-30/h2-3,6-13,16H,1,4-5,14-15,17-19H2
InChIKey
IIBUQVCVHHQIRK-UHFFFAOYSA-N
Synonyms

1((4bromobenzyl)sulfanyl)4(furan2ylmethyl)4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
1((4bromobenzyl)thio)4(furan2ylmethyl)4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=O)N(C5=NN=C(N45)SCC6=CC=C(C=C6)Br)CC7=CC=CO7
InChI=1SC30H27BrN4O2Sc3122121020(111322)19382933322834(182386163723)27(36)2526(35(28)29)24932721(24)1730(25)144151530h2361316H14514151719H2
MFCD02994270
ZINC000001835794
ZINC1835794

Check stock

See real-time availability and sample size for STK531599 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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