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dimethyl 2-{1-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]-7-methoxy-2,2-dimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene}-1,3-dithiole-4,5-dicarboxylate

Catalog ID
STK789424
SMILES COc1ccc2c(c1)N(C(=O)CSc1nc3c(o1)cccc3)C(C(=S)/C/2=C/1\SC(=C(S1)C(=O)OC)C(=O)OC)(C)C

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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 C28H24N2O7S4 MW 628.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N2O7S4/c1-28(2)23(38)20(26-40-21(24(32)35-4)22(41-26)25(33)36-5)15-11-10-14(34-3)12-17(15)30(28)19(31)13-39-27-29-16-8-6-7-9-18(16)37-27/h6-12H,13H2,1-5H3
InChIKey
AZGPRNBXAKDIDI-UHFFFAOYSA-N
Synonyms
348131-50-0
348131500
CC1(C(=S)C(=C2SC(=C(S2)C(=O)OC)C(=O)OC)C3=C(N1C(=O)CSC4=NC5=CC=CC=C5O4)C=C(C=C3)OC)C
COc1ccc2c(c1)N(C(=O)CSc1nc3c(o1)cccc3)C(C(=S)C2=C1SC(=C(S1)C(=O)OC)C(=O)OC)(C)C
DIMETHYL2(1((13BENZOXAZOL2YLSULFANYL)ACETYL)7METHOXY22DIMETHYL3THIOXO23DIHYDRO4(1H)QUINOLINYLIDENE)13DITHIOLE45DICARBOXYLATE
dimethyl2(1((13benzoxazol2ylsulfanyl)acetyl)7methoxy22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
DIMETHYL2(1(2(13BENZOXAZOL2YLSULFANYL)ACETYL)7METHOXY22DIMETHYL3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
dimethyl2(1(2(benzo(d)oxazol2ylthio)acetyl)7methoxy22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
InChI=1SC28H24N2O7S4c128(2)23(38)20(264021(24(32)354)22(4126)25(33)365)15111014(343)1217(15)30(28)19(31)1339272916867918(16)3727h612H13H215H3
MFCD01171266
ZINC000008430539
ZINC08430539
ZINC8430539

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Available files

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