Vitas-M small molecule compound

N-{[3-(4-fluorophenyl)-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]acetyl}-S-methyl-L-cysteine

Catalog ID
STL532050
SMILES CSC[C@@H](C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1c1ccc(cc1)F

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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 C25H22FNO6S MW 483.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22FNO6S/c1-12-16-8-18-19(14-4-6-15(26)7-5-14)10-32-22(18)13(2)23(16)33-25(31)17(12)9-21(28)27-20(11-34-3)24(29)30/h4-8,10,20H,9,11H2,1-3H3,(H,27,28)(H,29,30)/t20-/m0/s1
InChIKey
DNWUASSEOKQSLO-FQEVSTJZSA-N
Synonyms
957001-31-9
(2~(R))2((2(3(4fluorophenyl)59dimethyl7oxofuro(32g)chromen6yl)acetyl)amino)3methylsulfanylpropanoicacid
(2R)2((2(3(4FLUOROPHENYL)59DIMETHYL7OXOFURO(32G)CHROMEN6YL)ACETYL)AMINO)3METHYLSULFANYLPROPANOICACID
(R)2(2(3(4fluorophenyl)59dimethyl7oxo7Hfuro(32g)chromen6yl)acetamido)3(methylthio)propanoicacid
1777258
957001319
CSC(C@@H)(C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1c1ccc(cc1)F
InChI=1SC25H22FNO6Sc1121681819(144615(26)7514)103222(18)13(2)23(16)3325(31)17(12)921(28)2720(11343)24(29)30h481020H911H213H3(H2728)(H2930)t20m0s1
MFCD05676035
N((3(4fluorophenyl)59dimethyl7oxo7Hfuro(32g)chromen6yl)acetyl)SmethylLcysteine
ZINC000002122334
ZINC2122334

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.