Vitas-M small molecule compound

3-butyl-2-[(4-chlorobenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one

Catalog ID
STK547527
SMILES CCCCn1c(SCc2ccc(cc2)Cl)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

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 C28H31ClN2OS MW 479.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31ClN2OS/c1-2-3-17-31-26(32)24-25(30-27(31)33-19-20-11-13-22(29)14-12-20)23-10-6-5-9-21(23)18-28(24)15-7-4-8-16-28/h5-6,9-14H,2-4,7-8,15-19H2,1H3
InChIKey
YTXQQYSVVJFBOX-UHFFFAOYSA-N
Synonyms
489464-69-9
3butyl2((4chlorobenzyl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3butyl2((4chlorobenzyl)thio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3BUTYL2((4CHLOROPHENYL)METHYLSULFANYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
489464699
CCCCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC5=CC=C(C=C5)Cl
InChI=1SC28H31ClN2OSc123173126(32)2425(3027(31)331920111322(29)141220)231065921(23)1828(24)157481628h56914H24781519H21H3
MFCD03297785
ZINC000002284330
ZINC02284330
ZINC2284330

Check stock

See real-time availability and sample size for STK547527 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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