Vitas-M small molecule compound
tetramethyl 6'-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]-5',5',7'-trimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK789257
SMILES COc1ccc(cc1)/C=C/C(=O)N1c2c(C)cccc2C2=C(C1(C)C)SC(=C(C12SC(=C(S1)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC
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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 C35H33NO10S3 MW 723.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H33NO10S3/c1-18-10-9-11-21-23-29(34(2,3)36(25(18)21)22(37)17-14-19-12-15-20(42-4)16-13-19)47-26(31(39)44-6)24(30(38)43-5)35(23)48-27(32(40)45-7)28(49-35)33(41)46-8/h9-17H,1-8H3/b17-14+InChIKey
LLCQXUUXYVOLMK-SAPNQHFASA-NSynonyms
(E)tetramethyl6(3(4methoxyphenyl)acryloyl)557trimethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
CC1=CC=CC2=C1N(C(C3=C2C4(C(=C(S3)C(=O)OC)C(=O)OC)SC(=C(S4)C(=O)OC)C(=O)OC)(C)C)C(=O)C=CC5=CC=C(C=C5)OC
COc1ccc(cc1)C=CC(=O)N1c2c(C)cccc2C2=C(C1(C)C)SC(=C(C12SC(=C(S1)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC
InChI=1SC35H33NO10S3c11810911212329(34(23)36(25(18)21)22(37)171419121520(424)161319)4726(31(39)446)24(30(38)435)35(23)4827(32(40)457)28(4935)33(41)468h917H18H3b1714+
MFCD01014262
tetramethyl6((2E)3(4methoxyphenyl)prop2enoyl)557trimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl6((E)3(4methoxyphenyl)prop2enoyl)557trimethylspiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000097968835
ZINC97968835
Check stock
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