Vitas-M small molecule compound

1-(4-bromo-2-methylphenyl)-5-oxo-2-(1H-pyrrol-1-yl)-4-(thiophen-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile

Catalog ID
STK780718
SMILES N#CC1=C(n2cccc2)N(C2=C(C1c1cscc1)C(=O)CCC2)c1ccc(cc1C)Br

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 C25H20BrN3OS MW 490.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20BrN3OS/c1-16-13-18(26)7-8-20(16)29-21-5-4-6-22(30)24(21)23(17-9-12-31-15-17)19(14-27)25(29)28-10-2-3-11-28/h2-3,7-13,15,23H,4-6H2,1H3
InChIKey
BPSBKYHMDFSDMF-UHFFFAOYSA-N
Synonyms

1(4bromo2methylphenyl)5oxo2(1Hpyrrol1yl)4(thiophen3yl)145678hexahydroquinoline3carbonitrile
1(4bromo2methylphenyl)5oxo2pyrrol1yl4thiophen3yl4678tetrahydroquinoline3carbonitrile
CC1=C(C=CC(=C1)Br)N2C3=C(C(C(=C2N4C=CC=C4)C#N)C5=CSC=C5)C(=O)CCC3
InChI=1SC25H20BrN3OSc1161318(26)7820(16)292154622(30)24(21)23(17912311517)19(1427)25(29)2810231128h237131523H46H21H3
MFCD06013551
ZINC000001432005
ZINC000001432006

Check stock

See real-time availability and sample size for STK780718 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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