Vitas-M small molecule compound
dimethyl 2-{6-ethoxy-1-[(3-methoxyphenyl)carbonyl]-2,2-dimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene}-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK789681
SMILES CCOc1ccc2c(c1)/C(=C\1/SC(=C(S1)C(=O)OC)C(=O)OC)/C(=S)C(N2C(=O)c1cccc(c1)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 C28H27NO7S3 MW 585.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27NO7S3/c1-7-36-17-11-12-19-18(14-17)20(27-38-21(25(31)34-5)22(39-27)26(32)35-6)23(37)28(2,3)29(19)24(30)15-9-8-10-16(13-15)33-4/h8-14H,7H2,1-6H3InChIKey
FIOYVYMEHDETAU-UHFFFAOYSA-NSynonyms
CCOC1=CC2=C(C=C1)N(C(C(=S)C2=C3SC(=C(S3)C(=O)OC)C(=O)OC)(C)C)C(=O)C4=CC(=CC=C4)OC
CCOc1ccc2c(c1)C(=C1SC(=C(S1)C(=O)OC)C(=O)OC)C(=S)C(N2C(=O)c1cccc(c1)OC)(C)C
dimethyl2(6ethoxy1((3methoxyphenyl)carbonyl)22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
DIMETHYL2(6ETHOXY1(3METHOXYBENZOYL)22DIMETHYL3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
DIMETHYL2(6ETHOXY1(3METHOXYBENZOYL)22DIMETHYL3THIOXO23DIHYDRO4(1H)QUINOLINYLIDENE)13DITHIOLE45DICARBOXYLATE
dimethyl2(6ethoxy1(3methoxybenzoyl)22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
InChI=1SC28H27NO7S3c17361711121918(1417)20(273821(25(31)345)22(3927)26(32)356)23(37)28(23)29(19)24(30)15981016(1315)334h814H7H216H3
MFCD01795963
ZINC000008431792
ZINC08431792
ZINC8431792
Check stock
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Check stock on Vitas-MAvailable files
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