Vitas-M small molecule compound

1-(3,5-dichlorophenyl)-7,7-dimethyl-4-(thiophen-2-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione

Catalog ID
STK773110
SMILES Clc1cc(Cl)cc(c1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1cccs1

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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 C21H19Cl2NO2S MW 420.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19Cl2NO2S/c1-21(2)10-16-20(17(25)11-21)15(18-4-3-5-27-18)9-19(26)24(16)14-7-12(22)6-13(23)8-14/h3-8,15H,9-11H2,1-2H3
InChIKey
ZUJCBASXMZRCDW-UHFFFAOYSA-N
Synonyms

1(35dichlorophenyl)77dimethyl4(thiophen2yl)4678tetrahydroquinoline25(1H3H)dione
1(35dichlorophenyl)77dimethyl4thiophen2yl3468tetrahydroquinoline25dione
CC1(CC2=C(C(CC(=O)N2C3=CC(=CC(=C3)Cl)Cl)C4=CC=CS4)C(=O)C1)C
InChI=1SC21H19Cl2NO2Sc121(2)101620(17(25)1121)15(184352718)919(26)24(16)14712(22)613(23)814h3815H911H212H3
MFCD03821280
ZINC000001079902
ZINC000001079904

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Available files

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