Vitas-M small molecule compound

butyl 2-({[2-(furan-2-yl)quinolin-4-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK430317
SMILES CCCCOC(=O)c1c(sc2c1CCCC2)NC(=O)c1cc(nc2c1cccc2)c1ccco1

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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 C27H26N2O4S MW 474.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O4S/c1-2-3-14-33-27(31)24-18-10-5-7-13-23(18)34-26(24)29-25(30)19-16-21(22-12-8-15-32-22)28-20-11-6-4-9-17(19)20/h4,6,8-9,11-12,15-16H,2-3,5,7,10,13-14H2,1H3,(H,29,30)
InChIKey
XPYVVLONBLOWOJ-UHFFFAOYSA-N
Synonyms

butyl2(((2(furan2yl)quinolin4yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
butyl2((2(furan2yl)quinoline4carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
CCCCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CO5
InChI=1SC27H26N2O4Sc123143327(31)241810571323(18)3426(24)2925(30)191621(22128153222)28201164917(19)20h468911121516H2357101314H21H3(H2930)
MFCD03396564
ZINC000002794989
ZINC02794989
ZINC2794989

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Available files

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