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dimethyl 2-{1-[(2,4-dichlorophenyl)carbonyl]-2,2,6-trimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene}-1,3-dithiole-4,5-dicarboxylate

Catalog ID
STK067723
SMILES COC(=O)C1=C(S/C(=C/2\c3cc(C)ccc3N(C(C2=S)(C)C)C(=O)c2ccc(cc2Cl)Cl)/S1)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 C26H21Cl2NO5S3 MW 594.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21Cl2NO5S3/c1-12-6-9-17-15(10-12)18(25-36-19(23(31)33-4)20(37-25)24(32)34-5)21(35)26(2,3)29(17)22(30)14-8-7-13(27)11-16(14)28/h6-11H,1-5H3
InChIKey
HHDFQSDKAOGECW-UHFFFAOYSA-N
Synonyms

CC1=CC2=C(C=C1)N(C(C(=S)C2=C3SC(=C(S3)C(=O)OC)C(=O)OC)(C)C)C(=O)C4=C(C=C(C=C4)Cl)Cl
COC(=O)C1=C(SC(=C2c3cc(C)ccc3N(C(C2=S)(C)C)C(=O)c2ccc(cc2Cl)Cl)S1)C(=O)OC
DIMETHYL2(1((24DICHLOROPHENYL)CARBONYL)226TRIMETHYL3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
DIMETHYL2(1(24DICHLOROBENZOYL)226TRIMETHYL3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
dimethyl2(1(24dichlorobenzoyl)226trimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
InChI=1SC26H21Cl2NO5S3c112691715(1012)18(253619(23(31)334)20(3725)24(32)345)21(35)26(23)29(17)22(30)148713(27)1116(14)28h611H15H3
METHYL2(1((24DICHLOROPHENYL)CARBONYL)226TRIMETHYL3THIOXO(412DIHYDROQUINOLYLIDENE))5(METHOXYCARBONYL)13DITHIOLENE4CARBOXYLATE
MFCD01156243
STK067723
ZINC000098048860
ZINC98048860

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Available files

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