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dimethyl 2-[2,2,7-trimethyl-1-(naphthalen-1-ylacetyl)-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene]-1,3-dithiole-4,5-dicarboxylate

Catalog ID
STK320600
SMILES COC(=O)C1=C(S/C(=C/2\c3ccc(cc3N(C(C2=S)(C)C)C(=O)Cc2cccc3c2cccc3)C)/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 C31H27NO5S3 MW 589.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27NO5S3/c1-17-13-14-21-22(15-17)32(23(33)16-19-11-8-10-18-9-6-7-12-20(18)19)31(2,3)27(38)24(21)30-39-25(28(34)36-4)26(40-30)29(35)37-5/h6-15H,16H2,1-5H3
InChIKey
VUFAOCNMEHVDEL-UHFFFAOYSA-N
Synonyms

CC1=CC2=C(C=C1)C(=C3SC(=C(S3)C(=O)OC)C(=O)OC)C(=S)C(N2C(=O)CC4=CC=CC5=CC=CC=C54)(C)C
COC(=O)C1=C(SC(=C2c3ccc(cc3N(C(C2=S)(C)C)C(=O)Cc2cccc3c2cccc3)C)S1)C(=O)OC
DIMETHYL2(227TRIMETHYL1(1NAPHTHYLACETYL)3THIOXO23DIHYDRO4(1H)QUINOLINYLIDENE)13DITHIOLE45DICARBOXYLATE
dimethyl2(227trimethyl1(2(naphthalen1yl)acetyl)3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
DIMETHYL2(227TRIMETHYL1(2NAPHTHALEN1YLACETYL)3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
dimethyl2(227trimethyl1(naphthalen1ylacetyl)3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
InChI=1SC31H27NO5S3c11713142122(1517)32(23(33)161911810189671220(18)19)31(23)27(38)24(21)303925(28(34)364)26(4030)29(35)375h615H16H215H3
MFCD01137935
ZINC000008425637
ZINC08425637
ZINC8425637

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Available files

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