Vitas-M small molecule compound
methyl (4Z)-7-methoxy-2,2-dimethyl-4-[4-phenyl-5-(phenylcarbonyl)-1,3-dithiol-2-ylidene]-3-thioxo-3,4-dihydroquinoline-1(2H)-carboxylate
Catalog ID
STK508350
SMILES COc1ccc2c(c1)N(C(=O)OC)C(C(=S)/C/2=C\1/SC(=C(S1)C(=O)c1ccccc1)c1ccccc1)(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 C30H25NO4S3 MW 559.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25NO4S3/c1-30(2)27(36)23(21-16-15-20(34-3)17-22(21)31(30)29(33)35-4)28-37-25(19-13-9-6-10-14-19)26(38-28)24(32)18-11-7-5-8-12-18/h5-17H,1-4H3/b28-23-InChIKey
WYPHWPZKZRCEPW-NFFVHWSESA-NSynonyms
(Z)methyl4(4benzoyl5phenyl13dithiol2ylidene)7methoxy22dimethyl3thioxo34dihydroquinoline1(2H)carboxylate
CC1(C(=S)C(=C2SC(=C(S2)C(=O)C3=CC=CC=C3)C4=CC=CC=C4)C5=C(N1C(=O)OC)C=C(C=C5)OC)C
COc1ccc2c(c1)N(C(=O)OC)C(C(=S)C2=C1SC(=C(S1)C(=O)c1ccccc1)c1ccccc1)(C)C
InChI=1SC30H25NO4S3c130(2)27(36)23(21161520(343)1722(21)31(30)29(33)354)283725(191396101419)26(3828)24(32)18117581218h517H14H3b2823
METHYL(4Z)4(4BENZOYL5PHENYL13DITHIOL2YLIDENE)7METHOXY22DIMETHYL3SULFANYLIDENEQUINOLINE1CARBOXYLATE
methyl(4Z)7methoxy22dimethyl4(4phenyl5(phenylcarbonyl)13dithiol2ylidene)3thioxo34dihydroquinoline1(2H)carboxylate
MFCD03008992
ZINC000001756687
ZINC01756687
ZINC1756687
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Check stock on Vitas-MAvailable files
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