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ethyl (2Z)-2-{1-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetyl]-8-methoxy-2,2-dimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene}-5-phenyl-1,3-dithiole-4-carboxylate

Catalog ID
STK789337
SMILES CCOC(=O)C1=C(S/C(=C/2\c3cccc(c3N(C(C2=S)(C)C)C(=O)CN2C(=O)c3c(C2=O)cccc3)OC)/S1)c1ccccc1

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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 C34H28N2O6S3 MW 656.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H28N2O6S3/c1-5-42-32(40)28-27(19-12-7-6-8-13-19)44-33(45-28)25-22-16-11-17-23(41-4)26(22)36(34(2,3)29(25)43)24(37)18-35-30(38)20-14-9-10-15-21(20)31(35)39/h6-17H,5,18H2,1-4H3/b33-25-
InChIKey
JMQVHIVOJZROQY-IVQJCJPDSA-N
Synonyms

(Z)ethyl2(1(2(13dioxoisoindolin2yl)acetyl)8methoxy22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)5phenyl13dithiole4carboxylate
CCOC(=O)C1=C(SC(=C2C3=C(C(=CC=C3)OC)N(C(C2=S)(C)C)C(=O)CN4C(=O)C5=CC=CC=C5C4=O)S1)C6=CC=CC=C6
CCOC(=O)C1=C(SC(=C2c3cccc(c3N(C(C2=S)(C)C)C(=O)CN2C(=O)c3c(C2=O)cccc3)OC)S1)c1ccccc1
ethyl(2Z)2(1((13dioxo13dihydro2Hisoindol2yl)acetyl)8methoxy22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)5phenyl13dithiole4carboxylate
ETHYL(2Z)2(1(2(13DIOXOISOINDOL2YL)ACETYL)8METHOXY22DIMETHYL3SULFANYLIDENEQUINOLIN4YLIDENE)5PHENYL13DITHIOLE4CARBOXYLATE
ETHYL2(1((13DIOXO13DIHYDRO2HISOINDOL2YL)ACETYL)8METHOXY22DIMETHYL3THIOXO23DIHYDRO4(1H)QUINOLINYLIDENE)5PHENYL13DITHIOLE4CARBOXYLATE
InChI=1SC34H28N2O6S3c154232(40)2827(19127681319)4433(4528)252216111723(414)26(22)36(34(23)29(25)43)24(37)183530(38)20149101521(20)31(35)39h617H518H214H3b3325
MFCD01068179
ZINC000008396089
ZINC08396089
ZINC8396089

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Available files

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