Vitas-M small molecule compound

2-{[3-cyano-4-(2,3-dichlorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(2-ethylphenyl)acetamide

Catalog ID
STK543385
SMILES N#CC1=C(SCC(=O)Nc2ccccc2CC)NC2=C(C1c1cccc(c1Cl)Cl)C(=O)CCC2

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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 C26H23Cl2N3O2S MW 512.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23Cl2N3O2S/c1-2-15-7-3-4-10-19(15)30-22(33)14-34-26-17(13-29)23(16-8-5-9-18(27)25(16)28)24-20(31-26)11-6-12-21(24)32/h3-5,7-10,23,31H,2,6,11-12,14H2,1H3,(H,30,33)
InChIKey
JGXSEUNHMVBNCZ-UHFFFAOYSA-N
Synonyms
488805-03-4
2((3cyano4(23dichlorophenyl)5oxo145678hexahydroquinolin2yl)sulfanyl)N(2ethylphenyl)acetamide
2((3cyano4(23dichlorophenyl)5oxo145678hexahydroquinolin2yl)thio)N(2ethylphenyl)acetamide
2((3cyano4(23dichlorophenyl)5oxo4678tetrahydro1Hquinolin2yl)sulfanyl)N(2ethylphenyl)acetamide
488805034
CCC1=CC=CC=C1NC(=O)CSC2=C(C(C3=C(N2)CCCC3=O)C4=C(C(=CC=C4)Cl)Cl)C#N
InChI=1SC26H23Cl2N3O2Sc12157341019(15)3022(33)14342617(1329)23(1685918(27)25(16)28)2420(3126)1161221(24)32h357102331H26111214H21H3(H3033)
MFCD03293332
ZINC000013165973
ZINC000013165975

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Available files

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