Vitas-M small molecule compound

tetramethyl 9'-ethyl-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate

Catalog ID
STK060978
SMILES CCc1ccc2c(c1)C1=C(C(N2)(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 C26H27NO8S3 MW 577.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO8S3/c1-8-12-9-10-14-13(11-12)15-20(25(2,3)27-14)36-17(22(29)33-5)16(21(28)32-4)26(15)37-18(23(30)34-6)19(38-26)24(31)35-7/h9-11,27H,8H2,1-7H3
InChIKey
ZOZDZWBHEVGWFJ-UHFFFAOYSA-N
Synonyms

CCC1=CC2=C(C=C1)NC(C3=C2C4(C(=C(S3)C(=O)OC)C(=O)OC)SC(=C(S4)C(=O)OC)C(=O)OC)(C)C
CCc1ccc2c(c1)C1=C(C(N2)(C)C)SC(=C(C21SC(=C(S2)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC
InChI=1SC26H27NO8S3c18129101413(1112)1520(25(23)2714)3617(22(29)335)16(21(28)324)26(15)3718(23(30)346)19(3826)24(31)357h91127H8H217H3
MFCD02816967
STK060978
tetramethyl9ethyl55dimethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl9ethyl55dimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl9ethyl55dimethylspiro(13dithiole216Hthiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000100115308
ZINC100115308

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Available files

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