Vitas-M small molecule compound
dimethyl 2-{1-[(4-methoxyphenyl)carbonyl]-2,2-dimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene}-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK788994
SMILES COc1ccc(cc1)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)16-8-6-7-9-17(16)27(26)22(28)14-10-12-15(31-3)13-11-14/h6-13H,1-5H3InChIKey
MTWCEOOOJNCMEB-UHFFFAOYSA-NSynonyms
330561-00-7330561007
CC1(C(=S)C(=C2SC(=C(S2)C(=O)OC)C(=O)OC)C3=CC=CC=C3N1C(=O)C4=CC=C(C=C4)OC)C
COc1ccc(cc1)C(=O)N1c2ccccc2C(=C2SC(=C(S2)C(=O)OC)C(=O)OC)C(=S)C1(C)C
dimethyl2(1((4methoxyphenyl)carbonyl)22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
DIMETHYL2(1(4METHOXYBENZOYL)22DIMETHYL3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
dimethyl2(1(4methoxybenzoyl)22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
InChI=1SC26H23NO6S3c126(2)21(34)18(253519(23(29)324)20(3625)24(30)335)16867917(16)27(26)22(28)14101215(313)131114h613H15H3
METHYL5(METHOXYCARBONYL)2(1((4METHOXYPHENYL)CARBONYL)22DIMETHYL3THIOXO(412DIHYDROQUINOLYLIDENE))13DITHIOLENE4CARBOXYLATE
MFCD00521229
ZINC000006190997
ZINC6190997
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