Vitas-M small molecule compound
tetramethyl 8'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK395089
SMILES CCOc1ccc2c(c1)NC(C1=C2C2(SC(=C(S2)C(=O)OC)C(=O)OC)C(=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 C26H27NO9S3 MW 593.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO9S3/c1-8-36-12-9-10-13-14(11-12)27-25(2,3)20-15(13)26(16(21(28)32-4)17(37-20)22(29)33-5)38-18(23(30)34-6)19(39-26)24(31)35-7/h9-11,27H,8H2,1-7H3InChIKey
PCAXWBBJHFDFSN-UHFFFAOYSA-NSynonyms
CCOC1=CC2=C(C=C1)C3=C(C(N2)(C)C)SC(=C(C34SC(=C(S4)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC
CCOc1ccc2c(c1)NC(C1=C2(C@@)2(SC(=C(S2)C(=O)OC)C(=O)OC)C(=C(S1)C(=O)OC)C(=O)OC)(C)C
InChI=1SC26H27NO9S3c1836129101314(1112)2725(23)2015(13)26(16(21(28)324)17(3720)22(29)335)3818(23(30)346)19(3926)24(31)357h91127H8H217H3
MFCD00616862
tetramethyl8ethoxy55dimethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl8ethoxy55dimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetramethyl8ethoxy55dimethylspiro(13dithiole216Hthiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000004045104
ZINC04045104
ZINC4045104
Check stock
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Check stock on Vitas-MAvailable files
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