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Vitas-M small molecule compound

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

Catalog ID
STK055973
SMILES COc1ccc2c(c1)/C(=C\1/SC(=C(S1)C(=O)OC)C(=O)OC)/C(=S)C(N2C(=O)c1ccccc1)(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 C26H23NO6S3 MW 541.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23NO6S3/c1-26(2)21(34)18(25-35-19(23(29)32-4)20(36-25)24(30)33-5)16-13-15(31-3)11-12-17(16)27(26)22(28)14-9-7-6-8-10-14/h6-13H,1-5H3
InChIKey
FZPFUDKATLKQFX-UHFFFAOYSA-N
Synonyms
298190-24-6
298190246
CC1(C(=S)C(=C2SC(=C(S2)C(=O)OC)C(=O)OC)C3=C(N1C(=O)C4=CC=CC=C4)C=CC(=C3)OC)C
COc1ccc2c(c1)C(=C1SC(=C(S1)C(=O)OC)C(=O)OC)C(=S)C(N2C(=O)c1ccccc1)(C)C
DIMETHYL2(1BENZOYL6METHOXY22DIMETHYL3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
DIMETHYL2(1BENZOYL6METHOXY22DIMETHYL3THIOXO23DIHYDRO4(1H)QUINOLINYLIDENE)13DITHIOLE45DICARBOXYLATE
dimethyl2(1benzoyl6methoxy22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
DIMETHYL2(6METHOXY22DIMETHYL1(PHENYLCARBONYL)3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
InChI=1SC26H23NO6S3c126(2)21(34)18(253519(23(29)324)20(3625)24(30)335)161315(313)111217(16)27(26)22(28)1497681014h613H15H3
METHYL2(6METHOXY22DIMETHYL1(PHENYLCARBONYL)3THIOXO(412DIHYDROQUINOLYLIDENE))5(METHOXYCARBONYL)13DITHIOLENE4CARBOXYLATE
MFCD00627098
STK055973
ZINC000004091142
ZINC04091142
ZINC4091142

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Available files

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