Vitas-M small molecule compound
dimethyl 2-{8-ethoxy-1-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]-2,2-dimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene}-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK083976
SMILES CCOc1cccc2c1N(C(=O)/C=C/c1ccc(cc1)OC)C(C(=S)/C/2=C/1\SC(=C(S1)C(=O)OC)C(=O)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 C30H29NO7S3 MW 611.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29NO7S3/c1-7-38-20-10-8-9-19-22(29-40-24(27(33)36-5)25(41-29)28(34)37-6)26(39)30(2,3)31(23(19)20)21(32)16-13-17-11-14-18(35-4)15-12-17/h8-16H,7H2,1-6H3/b16-13+InChIKey
WMZAPNFYSLVBKD-DTQAZKPQSA-NSynonyms
(E)dimethyl2(8ethoxy1(3(4methoxyphenyl)acryloyl)22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
CCOC1=CC=CC2=C1N(C(C(=S)C2=C3SC(=C(S3)C(=O)OC)C(=O)OC)(C)C)C(=O)C=CC4=CC=C(C=C4)OC
CCOc1cccc2c1N(C(=O)C=Cc1ccc(cc1)OC)C(C(=S)C2=C1SC(=C(S1)C(=O)OC)C(=O)OC)(C)C
DIMETHYL2(8ETHOXY1((2E)3(4METHOXYPHENYL)PROP2ENOYL)22DIMETHYL3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
DIMETHYL2(8ETHOXY1((E)3(4METHOXYPHENYL)PROP2ENOYL)22DIMETHYL3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
InChI=1SC30H29NO7S3c17382010891922(294024(27(33)365)25(4129)28(34)376)26(39)30(23)31(23(19)20)21(32)161317111418(354)151217h816H7H216H3b1613+
MFCD01079442
STK083976
ZINC000097959105
ZINC97959105
Check stock
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