Vitas-M small molecule compound

2-(4-bromophenyl)-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)quinoline-4-carboxamide

Catalog ID
STK419474
SMILES N#Cc1c(NC(=O)c2cc(nc3c2cccc3)c2ccc(cc2)Br)sc2c1CCC(C2)C

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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 C26H20BrN3OS MW 502.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20BrN3OS/c1-15-6-11-19-21(14-28)26(32-24(19)12-15)30-25(31)20-13-23(16-7-9-17(27)10-8-16)29-22-5-3-2-4-18(20)22/h2-5,7-10,13,15H,6,11-12H2,1H3,(H,30,31)
InChIKey
YFPZBWVZYJBZPY-UHFFFAOYSA-N
Synonyms
352683-60-4
2(4bromophenyl)N(3cyano6methyl4567tetrahydro1benzothiophen2yl)quinoline4carboxamide
352683604
CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)Br
InChI=1SC26H20BrN3OSc1156111921(1428)26(3224(19)1215)3025(31)201323(167917(27)10816)2922532418(20)22h257101315H61112H21H3(H3031)
MFCD01350777
ZINC000002740518
ZINC000002740519

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Available files

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