Vitas-M small molecule compound
tetraethyl 5',5',8'-trimethyl-6'-(trifluoroacetyl)-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK052286
SMILES CCOC(=O)C1=C(SC2(S1)C(=C(SC1=C2c2ccc(cc2N(C1(C)C)C(=O)C(F)(F)F)C)C(=O)OCC)C(=O)OCC)C(=O)OCC
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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 C31H32F3NO9S3 MW 715.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32F3NO9S3/c1-8-41-24(36)19-20(25(37)42-9-2)45-23-18(30(19)46-21(26(38)43-10-3)22(47-30)27(39)44-11-4)16-13-12-15(5)14-17(16)35(29(23,6)7)28(40)31(32,33)34/h12-14H,8-11H2,1-7H3InChIKey
NFADPJCFIYZXAF-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2(S1)C(=C(SC1=C2c2ccc(cc2N(C1(C)C)C(=O)C(F)(F)F)C)C(=O)OCC)C(=O)OCC)C(=O)OCC
CCOC(=O)C1=C(SC2=C(C13SC(=C(S3)C(=O)OCC)C(=O)OCC)C4=C(C=C(C=C4)C)N(C2(C)C)C(=O)C(F)(F)F)C(=O)OCC
InChI=1SC31H32F3NO9S3c184124(36)1920(25(37)4292)452318(30(19)4621(26(38)43103)22(4730)27(39)44114)16131215(5)1417(16)35(29(236)7)28(40)31(3233)34h1214H811H217H3
MFCD01156169
STK052286
tetraethyl558trimethyl6(222trifluoroacetyl)56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetraethyl558trimethyl6(222trifluoroacetyl)spiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetraethyl558trimethyl6(trifluoroacetyl)56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000008425729
ZINC08425729
ZINC8425729
Check stock
See real-time availability and sample size for STK052286 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.