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diethyl 2-[6-methoxy-2,2-dimethyl-1-(phenoxyacetyl)-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene]-1,3-dithiole-4,5-dicarboxylate

Catalog ID
STK055786
SMILES CCOC(=O)C1=C(S/C(=C/2\c3cc(OC)ccc3N(C(C2=S)(C)C)C(=O)COc2ccccc2)/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 C29H29NO7S3 MW 599.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29NO7S3/c1-6-35-26(32)23-24(27(33)36-7-2)40-28(39-23)22-19-15-18(34-5)13-14-20(19)30(29(3,4)25(22)38)21(31)16-37-17-11-9-8-10-12-17/h8-15H,6-7,16H2,1-5H3
InChIKey
LMVHVKGXOBTQOX-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C2C3=C(C=CC(=C3)OC)N(C(C2=S)(C)C)C(=O)COC4=CC=CC=C4)S1)C(=O)OCC
CCOC(=O)C1=C(SC(=C2c3cc(OC)ccc3N(C(C2=S)(C)C)C(=O)COc2ccccc2)S1)C(=O)OCC
DIETHYL2(6METHOXY22DIMETHYL1(2PHENOXYACETYL)3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
diethyl2(6methoxy22dimethyl1(2phenoxyacetyl)3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
DIETHYL2(6METHOXY22DIMETHYL1(PHENOXYACETYL)3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
ETHYL5(ETHOXYCARBONYL)2(6METHOXY22DIMETHYL1(2PHENOXYACETYL)3THIOXO(412DIHYDROQUINOLYLIDENE))13DITHIOLENE4CARBOXYLATE
InChI=1SC29H29NO7S3c163526(32)2324(27(33)3672)4028(3923)22191518(345)131420(19)30(29(34)25(22)38)21(31)1637171198101217h815H6716H215H3
MFCD01859149
STK055786
ZINC000100112954
ZINC100112954

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Available files

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