Vitas-M small molecule compound
dimethyl 2-{1-[(3-methoxyphenyl)carbonyl]-2,2-dimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene}-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK789087
SMILES COc1cccc(c1)C(=O)N1c2ccccc2/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 C26H23NO6S3 MW 541.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23NO6S3/c1-26(2)21(34)18(25-35-19(23(29)32-4)20(36-25)24(30)33-5)16-11-6-7-12-17(16)27(26)22(28)14-9-8-10-15(13-14)31-3/h6-13H,1-5H3InChIKey
QARHMVWDLFDOLE-UHFFFAOYSA-NSynonyms
303179-87-5303179875
CC1(C(=S)C(=C2SC(=C(S2)C(=O)OC)C(=O)OC)C3=CC=CC=C3N1C(=O)C4=CC(=CC=C4)OC)C
COc1cccc(c1)C(=O)N1c2ccccc2C(=C2SC(=C(S2)C(=O)OC)C(=O)OC)C(=S)C1(C)C
dimethyl2(1((3methoxyphenyl)carbonyl)22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
DIMETHYL2(1(3METHOXYBENZOYL)22DIMETHYL3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
dimethyl2(1(3methoxybenzoyl)22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
InChI=1SC26H23NO6S3c126(2)21(34)18(253519(23(29)324)20(3625)24(30)335)1611671217(16)27(26)22(28)14981015(1314)313h613H15H3
METHYL5(METHOXYCARBONYL)2(1((3METHOXYPHENYL)CARBONYL)22DIMETHYL3THIOXO(412DIHYDROQUINOLYLIDENE))13DITHIOLENE4CARBOXYLATE
MFCD00658097
ZINC000006191002
ZINC6191002
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