Vitas-M small molecule compound
tetraethyl 6'-[(3-fluorophenyl)carbonyl]-5',5',8'-trimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK325102
SMILES CCOC(=O)C1=C(C(=O)OCC)C2(C3=C(S1)C(C)(C)N(c1c3ccc(c1)C)C(=O)c1cccc(c1)F)SC(=C(S2)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 C36H36FNO9S3 MW 741.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H36FNO9S3/c1-8-44-31(40)25-26(32(41)45-9-2)48-29-24(36(25)49-27(33(42)46-10-3)28(50-36)34(43)47-11-4)22-16-15-19(5)17-23(22)38(35(29,6)7)30(39)20-13-12-14-21(37)18-20/h12-18H,8-11H2,1-7H3InChIKey
NMFZIGULXUWBIA-UHFFFAOYSA-NSynonyms
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)C5=CC(=CC=C5)F)C(=O)OCC
InChI=1SC36H36FNO9S3c184431(40)2526(32(41)4592)482924(36(25)4927(33(42)46103)28(5036)34(43)47114)22161519(5)1723(22)38(35(296)7)30(39)2013121421(37)1820h1218H811H217H3
MFCD00630844
tetraethyl6((3fluorophenyl)carbonyl)558trimethyl56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetraethyl6(3fluorobenzoyl)558trimethyl56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetraethyl6(3fluorobenzoyl)558trimethylspiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000008398239
ZINC08398239
ZINC8398239
Check stock
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Check stock on Vitas-MAvailable files
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