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dimethyl 2-{1-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-phenylpropanoyl]-6-methoxy-2,2-dimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene}-1,3-dithiole-4,5-dicarboxylate

Catalog ID
STK082513
SMILES COC(=O)C1=C(S/C(=C/2\c3cc(OC)ccc3N(C(C2=S)(C)C)C(=O)C(N2C(=O)c3c(C2=O)cccc3)Cc2ccccc2)/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 C36H30N2O8S3 MW 714.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H30N2O8S3/c1-36(2)29(47)26(35-48-27(33(42)45-4)28(49-35)34(43)46-5)23-18-20(44-3)15-16-24(23)38(36)32(41)25(17-19-11-7-6-8-12-19)37-30(39)21-13-9-10-14-22(21)31(37)40/h6-16,18,25H,17H2,1-5H3
InChIKey
MWNPMOGEKVBAIE-UHFFFAOYSA-N
Synonyms

CC1(C(=S)C(=C2SC(=C(S2)C(=O)OC)C(=O)OC)C3=C(N1C(=O)C(CC4=CC=CC=C4)N5C(=O)C6=CC=CC=C6C5=O)C=CC(=C3)OC)C
COC(=O)C1=C(SC(=C2c3cc(OC)ccc3N(C(C2=S)(C)C)C(=O)C(N2C(=O)c3c(C2=O)cccc3)Cc2ccccc2)S1)C(=O)OC
DIMETHYL2(1(2(13DIOXO13DIHYDRO2HISOINDOL2YL)3PHENYLPROPANOYL)6METHOXY22DIMETHYL3THIOXO23DIHYDRO4(1H)QUINOLINYLIDENE)13DITHIOLE45DICARBOXYLATE
DIMETHYL2(1(2(13DIOXO13DIHYDRO2HISOINDOL2YL)3PHENYLPROPANOYL)6METHOXY22DIMETHYL3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
DIMETHYL2(1(2(13DIOXOISOINDOL2YL)3PHENYLPROPANOYL)6METHOXY22DIMETHYL3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
dimethyl2(1(2(13dioxoisoindolin2yl)3phenylpropanoyl)6methoxy22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
InChI=1SC36H30N2O8S3c136(2)29(47)26(354827(33(42)454)28(4935)34(43)465)231820(443)151624(23)38(36)32(41)25(1719117681219)3730(39)21139101422(21)31(37)40h6161825H17H215H3
METHYL2(1(2(13DIOXOBENZO(C)AZOLIN2YL)3PHENYLPROPANOYL)6METHOXY22DIMETHYL3THIOXO(412DIHYDROQUINOLYLIDENE))5(METHOXYCARBONYL)13DITHIOLENE4CARBOXYLATE
MFCD01171286
STK082513
ZINC000008430680
ZINC000008430682

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Available files

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