Vitas-M small molecule compound

2-(4-bromophenyl)-N-(3-cyano-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide

Catalog ID
STK427583
SMILES N#Cc1c(sc(c1C)C)NC(=O)c1cc(nc2c1cccc2)c1ccc(cc1)Br

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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 C23H16BrN3OS MW 462.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16BrN3OS/c1-13-14(2)29-23(19(13)12-25)27-22(28)18-11-21(15-7-9-16(24)10-8-15)26-20-6-4-3-5-17(18)20/h3-11H,1-2H3,(H,27,28)
InChIKey
KVDRFDOAAXRRCN-UHFFFAOYSA-N
Synonyms

(2(4BROMOPHENYL)(4QUINOLYL))N(3CYANO45DIMETHYL(2THIENYL))CARBOXAMIDE
2(4bromophenyl)N(3cyano45dimethylthiophen2yl)quinoline4carboxamide
CC1=C(SC(=C1C#N)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br)C
InChI=1SC23H16BrN3OSc11314(2)2923(19(13)1225)2722(28)181121(157916(24)10815)2620643517(18)20h311H12H3(H2728)
MFCD01345400
ZINC000002737435
ZINC02737435
ZINC2737435

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Available files

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