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diethyl 2-{1-[(2,5-dioxopyrrolidin-1-yl)acetyl]-2,2,6-trimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene}-1,3-dithiole-4,5-dicarboxylate

Catalog ID
STK088561
SMILES CCOC(=O)C1=C(S/C(=C\2/c3cc(C)ccc3N(C(C2=S)(C)C)C(=O)CN2C(=O)CCC2=O)/S1)C(=O)OCC

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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 C27H28N2O7S3 MW 588.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O7S3/c1-6-35-24(33)21-22(25(34)36-7-2)39-26(38-21)20-15-12-14(3)8-9-16(15)29(27(4,5)23(20)37)19(32)13-28-17(30)10-11-18(28)31/h8-9,12H,6-7,10-11,13H2,1-5H3
InChIKey
WLXSWVXVIZLOHL-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C2C3=C(C=CC(=C3)C)N(C(C2=S)(C)C)C(=O)CN4C(=O)CCC4=O)S1)C(=O)OCC
CCOC(=O)C1=C(SC(=C2c3cc(C)ccc3N(C(C2=S)(C)C)C(=O)CN2C(=O)CCC2=O)S1)C(=O)OCC
DIETHYL2(1((25DIOXO1PYRROLIDINYL)ACETYL)226TRIMETHYL3THIOXO23DIHYDRO4(1H)QUINOLINYLIDENE)13DITHIOLE45DICARBOXYLATE
DIETHYL2(1((25DIOXOPYRROLIDIN1YL)ACETYL)226TRIMETHYL3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
DIETHYL2(1(2(25DIOXOPYRROLIDIN1YL)ACETYL)226TRIMETHYL3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
diethyl2(1(2(25dioxopyrrolidin1yl)acetyl)226trimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
ETHYL2(1(2(25DIOXOAZOLIDINYL)ACETYL)226TRIMETHYL3THIOXO(412DIHYDROQUINOLYLIDENE))5(ETHOXYCARBONYL)13DITHIOLENE4CARBOXYLATE
InChI=1SC27H28N2O7S3c163524(33)2122(25(34)3672)3926(3821)20151214(3)8916(15)29(27(45)23(20)37)19(32)132817(30)101118(28)31h8912H67101113H215H3
MFCD01956501
STK088561
ZINC000008432155
ZINC08432155
ZINC8432155

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Available files

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