Vitas-M small molecule compound

dimethyl 2-(1-acryloyl-2,2,8-trimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4,5-dicarboxylate

Catalog ID
STK076538
SMILES C=CC(=O)N1c2c(C)cccc2/C(=C\2/SC(=C(S2)C(=O)OC)C(=O)OC)/C(=S)C1(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 C22H21NO5S3 MW 475.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO5S3/c1-7-13(24)23-15-11(2)9-8-10-12(15)14(18(29)22(23,3)4)21-30-16(19(25)27-5)17(31-21)20(26)28-6/h7-10H,1H2,2-6H3
InChIKey
ATUUBMOGTSIPLL-UHFFFAOYSA-N
Synonyms
332144-09-9
332144099
C=CC(=O)N1c2c(C)cccc2C(=C2SC(=C(S2)C(=O)OC)C(=O)OC)C(=S)C1(C)C
CC1=CC=CC2=C1N(C(C(=S)C2=C3SC(=C(S3)C(=O)OC)C(=O)OC)(C)C)C(=O)C=C
DIMETHYL2(1ACRYLOYL228TRIMETHYL3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
DIMETHYL2(228TRIMETHYL1PROP2ENOYL3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
InChI=1SC22H21NO5S3c1713(24)231511(2)981012(15)14(18(29)22(233)4)213016(19(25)275)17(3121)20(26)286h710H1H226H3
METHYL5(METHOXYCARBONYL)2(228TRIMETHYL1PROP2ENOYL3THIOXO(412DIHYDROQUINOLYLIDENE))13DITHIOLENE4CARBOXYLATE
MFCD01796179
STK076538
ZINC000009056343
ZINC09056343
ZINC9056343

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Available files

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