Vitas-M small molecule compound

dimethyl 2-(7-methoxy-2,2-dimethyl-1-propanoyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4,5-dicarboxylate

Catalog ID
STK789184
SMILES COc1ccc2c(c1)N(C(=O)CC)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 C22H23NO6S3 MW 493.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO6S3/c1-7-14(24)23-13-10-11(27-4)8-9-12(13)15(18(30)22(23,2)3)21-31-16(19(25)28-5)17(32-21)20(26)29-6/h8-10H,7H2,1-6H3
InChIKey
WFCZHHVTNKFDFN-UHFFFAOYSA-N
Synonyms
331416-89-8
331416898
CCC(=O)N1C2=C(C=CC(=C2)OC)C(=C3SC(=C(S3)C(=O)OC)C(=O)OC)C(=S)C1(C)C
COc1ccc2c(c1)N(C(=O)CC)C(C(=S)C2=C1SC(=C(S1)C(=O)OC)C(=O)OC)(C)C
DIMETHYL2(22DIMETHYL7(METHYLOXY)1PROPANOYL3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
DIMETHYL2(7METHOXY22DIMETHYL1PROPANOYL3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
dimethyl2(7methoxy22dimethyl1propanoyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
dimethyl2(7methoxy22dimethyl1propionyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
InChI=1SC22H23NO6S3c1714(24)23131011(274)8912(13)15(18(30)22(232)3)213116(19(25)285)17(3221)20(26)296h810H7H216H3
METHYL2(7METHOXY22DIMETHYL1PROPANOYL3THIOXO(412DIHYDROQUINOLYLIDENE))5(METHOXYCARBONYL)13DITHIOLENE4CARBOXYLATE
MFCD00689674
ZINC000006461868
ZINC06461868
ZINC6461868

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Available files

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