Vitas-M small molecule compound
tetramethyl 9'-methoxy-6'-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK789255
SMILES COc1ccc2c(c1)C1=C(C(N2C(=O)/C=C/c2ccc(cc2)OC)(C)C)SC(=C(C21SC(=C(S2)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 C35H33NO11S3 MW 739.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H33NO11S3/c1-34(2)29-24(21-17-20(43-4)14-15-22(21)36(34)23(37)16-11-18-9-12-19(42-3)13-10-18)35(25(30(38)44-5)26(48-29)31(39)45-6)49-27(32(40)46-7)28(50-35)33(41)47-8/h9-17H,1-8H3/b16-11+InChIKey
VLHSNAWDDKKFNP-LFIBNONCSA-NSynonyms
(E)tetramethyl9methoxy6(3(4methoxyphenyl)acryloyl)55dimethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
CC1(C2=C(C3=C(N1C(=O)C=CC4=CC=C(C=C4)OC)C=CC(=C3)OC)C5(C(=C(S2)C(=O)OC)C(=O)OC)SC(=C(S5)C(=O)OC)C(=O)OC)C
COc1ccc2c(c1)C1=C(C(N2C(=O)C=Cc2ccc(cc2)OC)(C)C)SC(=C(C21SC(=C(S2)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC
InChI=1SC35H33NO11S3c134(2)2924(211720(434)141522(21)36(34)23(37)16111891219(423)131018)35(25(30(38)445)26(4829)31(39)456)4927(32(40)467)28(5035)33(41)478h917H18H3b1611+
MFCD01079432
tetramethyl9methoxy6((2E)3(4methoxyphenyl)prop2enoyl)55dimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl9methoxy6((E)3(4methoxyphenyl)prop2enoyl)55dimethylspiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000097965943
ZINC97965943
Check stock
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Check stock on Vitas-MAvailable files
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