Vitas-M small molecule compound

diethyl 2-(2,2-dimethyl-1-propyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4,5-dicarboxylate

Catalog ID
STK137132
SMILES CCCN1c2ccccc2/C(=C\2/SC(=C(S2)C(=O)OCC)C(=O)OCC)/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 C23H27NO4S3 MW 477.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27NO4S3/c1-6-13-24-15-12-10-9-11-14(15)16(19(29)23(24,4)5)22-30-17(20(25)27-7-2)18(31-22)21(26)28-8-3/h9-12H,6-8,13H2,1-5H3
InChIKey
KCUACFMIWQXYLF-UHFFFAOYSA-N
Synonyms
511514-93-5
511514935
CCCN1C2=CC=CC=C2C(=C3SC(=C(S3)C(=O)OCC)C(=O)OCC)C(=S)C1(C)C
CCCN1c2ccccc2C(=C2SC(=C(S2)C(=O)OCC)C(=O)OCC)C(=S)C1(C)C
DIETHYL2(22DIMETHYL1PROPYL3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
DIETHYL2(22DIMETHYL1PROPYL3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
InChI=1SC23H27NO4S3c16132415121091114(15)16(19(29)23(244)5)223017(20(25)2772)18(3122)21(26)2883h912H6813H215H3
MFCD03490313
ZINC000009463787
ZINC09463787
ZINC9463787

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Available files

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