Vitas-M small molecule compound
dimethyl 2-{1-[(4-chlorophenoxy)acetyl]-2,2-dimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene}-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK300103
SMILES COC(=O)C1=C(S/C(=C/2\c3ccccc3N(C(C2=S)(C)C)C(=O)COc2ccc(cc2)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 C26H22ClNO6S3 MW 576.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClNO6S3/c1-26(2)22(35)19(25-36-20(23(30)32-3)21(37-25)24(31)33-4)16-7-5-6-8-17(16)28(26)18(29)13-34-15-11-9-14(27)10-12-15/h5-12H,13H2,1-4H3InChIKey
QMZJAYVHQSJAPO-UHFFFAOYSA-NSynonyms
CC1(C(=S)C(=C2SC(=C(S2)C(=O)OC)C(=O)OC)C3=CC=CC=C3N1C(=O)COC4=CC=C(C=C4)Cl)C
COC(=O)C1=C(SC(=C2c3ccccc3N(C(C2=S)(C)C)C(=O)COc2ccc(cc2)Cl)S1)C(=O)OC
DIMETHYL2(1((4CHLOROPHENOXY)ACETYL)22DIMETHYL3THIOXO23DIHYDRO4(1H)QUINOLINYLIDENE)13DITHIOLE45DICARBOXYLATE
DIMETHYL2(1((4CHLOROPHENOXY)ACETYL)22DIMETHYL3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
DIMETHYL2(1(2(4CHLOROPHENOXY)ACETYL)22DIMETHYL3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
dimethyl2(1(2(4chlorophenoxy)acetyl)22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
InChI=1SC26H22ClNO6S3c126(2)22(35)19(253620(23(30)323)21(3725)24(31)334)16756817(16)28(26)18(29)13341511914(27)101215h512H13H214H3
METHYL2(1(2(4CHLOROPHENOXY)ACETYL)22DIMETHYL3THIOXO(412DIHYDROQUINOLYLIDENE))5(METHOXYCARBONYL)13DITHIOLENE4CARBOXYLATE
MFCD01560338
ZINC000006190991
ZINC06190991
ZINC6190991
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