Vitas-M small molecule compound

dimethyl 5-({[2-(3,4-dichlorophenyl)quinolin-4-yl]carbonyl}amino)-3-methylthiophene-2,4-dicarboxylate

Catalog ID
STK428512
SMILES COC(=O)c1c(NC(=O)c2cc(nc3c2cccc3)c2ccc(c(c2)Cl)Cl)sc(c1C)C(=O)OC

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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 C25H18Cl2N2O5S MW 529.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18Cl2N2O5S/c1-12-20(24(31)33-2)23(35-21(12)25(32)34-3)29-22(30)15-11-19(13-8-9-16(26)17(27)10-13)28-18-7-5-4-6-14(15)18/h4-11H,1-3H3,(H,29,30)
InChIKey
BYYXDSYUPOHQGF-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=C(C=C4)Cl)Cl)C(=O)OC
DIMETHYL5(((2(34DICHLOROPHENYL)4QUINOLINYL)CARBONYL)AMINO)3METHYL24THIOPHENEDICARBOXYLATE
dimethyl5(((2(34dichlorophenyl)quinolin4yl)carbonyl)amino)3methylthiophene24dicarboxylate
DIMETHYL5((2(34DICHLOROPHENYL)QUINOLINE4CARBONYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
InChI=1SC25H18Cl2N2O5Sc11220(24(31)332)23(3521(12)25(32)343)2922(30)151119(138916(26)17(27)1013)2818754614(15)18h411H13H3(H2930)
METHYL2((2(34DICHLOROPHENYL)(4QUINOLYL))CARBONYLAMINO)5(METHOXYCARBONYL)4METHYLTHIOPHENE3CARBOXYLATE
MFCD02372205
ZINC000002759897
ZINC02759897
ZINC2759897

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Available files

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