Vitas-M small molecule compound

2-{[3-cyano-4-(furan-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide

Catalog ID
STK839700
SMILES N#Cc1c(SCC(=O)Nc2cccc(c2)C)nc2c(c1c1ccco1)CCCC2

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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 C23H21N3O2S MW 403.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O2S/c1-15-6-4-7-16(12-15)25-21(27)14-29-23-18(13-24)22(20-10-5-11-28-20)17-8-2-3-9-19(17)26-23/h4-7,10-12H,2-3,8-9,14H2,1H3,(H,25,27)
InChIKey
ITWYEFXYIRTIAI-UHFFFAOYSA-N
Synonyms
370843-80-4
2((3cyano4(furan2yl)5678tetrahydroquinolin2yl)sulfanyl)N(3methylphenyl)acetamide
2((3cyano4(furan2yl)5678tetrahydroquinolin2yl)thio)N(mtolyl)acetamide
370843804
CC1=CC(=CC=C1)NC(=O)CSC2=NC3=C(CCCC3)C(=C2C#N)C4=CC=CO4
InChI=1SC23H21N3O2Sc11564716(1215)2521(27)14292318(1324)22(20105112820)17823919(17)2623h471012H238914H21H3(H2527)
MFCD02943045
ZINC000000715879
ZINC00715879
ZINC715879

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Available files

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