Vitas-M small molecule compound

dimethyl 2-[2,2,6,7-tetramethyl-1-(thiophen-2-ylacetyl)-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene]-1,3-dithiole-4,5-dicarboxylate

Catalog ID
STK038668
SMILES COC(=O)C1=C(S/C(=C\2/c3cc(C)c(cc3N(C(C2=S)(C)C)C(=O)Cc2cccs2)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 C26H25NO5S4 MW 559.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25NO5S4/c1-13-10-16-17(11-14(13)2)27(18(28)12-15-8-7-9-34-15)26(3,4)22(33)19(16)25-35-20(23(29)31-5)21(36-25)24(30)32-6/h7-11H,12H2,1-6H3
InChIKey
KNZUDAWLIXOFKR-UHFFFAOYSA-N
Synonyms

CC1=C(C=C2C(=C1)C(=C3SC(=C(S3)C(=O)OC)C(=O)OC)C(=S)C(N2C(=O)CC4=CC=CS4)(C)C)C
COC(=O)C1=C(SC(=C2c3cc(C)c(cc3N(C(C2=S)(C)C)C(=O)Cc2cccs2)C)S1)C(=O)OC
dimethyl2(2267tetramethyl1(2(thiophen2yl)acetyl)3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
dimethyl2(2267tetramethyl1(thiophen2ylacetyl)3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
dimethyl2(2267tetramethyl3sulfanylidene1(2thiophen2ylacetyl)quinolin4ylidene)13dithiole45dicarboxylate
InChI=1SC26H25NO5S4c113101617(1114(13)2)27(18(28)12158793415)26(34)22(33)19(16)253520(23(29)315)21(3625)24(30)326h711H12H216H3
MFCD03190478
STK038668
ZINC000100116147
ZINC100116147

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Available files

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