Vitas-M small molecule compound
dimethyl 2-{1-[(2,4-dichlorophenyl)carbonyl]-2,2-dimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene}-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK066830
SMILES COC(=O)C1=C(S/C(=C\2/c3ccccc3N(C(C2=S)(C)C)C(=O)c2ccc(cc2Cl)Cl)/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 C25H19Cl2NO5S3 MW 580.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19Cl2NO5S3/c1-25(2)20(34)17(24-35-18(22(30)32-3)19(36-24)23(31)33-4)14-7-5-6-8-16(14)28(25)21(29)13-10-9-12(26)11-15(13)27/h5-11H,1-4H3InChIKey
LEXUSDOBIWPOIA-UHFFFAOYSA-NSynonyms
CC1(C(=S)C(=C2SC(=C(S2)C(=O)OC)C(=O)OC)C3=CC=CC=C3N1C(=O)C4=C(C=C(C=C4)Cl)Cl)C
COC(=O)C1=C(SC(=C2c3ccccc3N(C(C2=S)(C)C)C(=O)c2ccc(cc2Cl)Cl)S1)C(=O)OC
DIMETHYL2(1((24DICHLOROPHENYL)CARBONYL)22DIMETHYL3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
DIMETHYL2(1(24DICHLOROBENZOYL)22DIMETHYL3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
DIMETHYL2(1(24DICHLOROBENZOYL)22DIMETHYL3THIOXO23DIHYDRO4(1H)QUINOLINYLIDENE)13DITHIOLE45DICARBOXYLATE
dimethyl2(1(24dichlorobenzoyl)22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
InChI=1SC25H19Cl2NO5S3c125(2)20(34)17(243518(22(30)323)19(3624)23(31)334)14756816(14)28(25)21(29)1310912(26)1115(13)27h511H14H3
METHYL2(1((24DICHLOROPHENYL)CARBONYL)22DIMETHYL3THIOXO(412DIHYDROQUINOLYLIDENE))5(METHOXYCARBONYL)13DITHIOLENE4CARBOXYLATE
MFCD01563886
STK066830
ZINC000008431712
ZINC08431712
ZINC8431712
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