Vitas-M small molecule compound
butyl 4-[(Z)-{2,4-dioxo-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-5-ylidene}methyl]benzoate
Catalog ID
STL035587
SMILES CCCCOC(=O)c1ccc(cc1)/C=C/1\SC(=O)N(C1=O)c1cccc(c1)C(F)(F)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 C22H18F3NO4S MW 449.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18F3NO4S/c1-2-3-11-30-20(28)15-9-7-14(8-10-15)12-18-19(27)26(21(29)31-18)17-6-4-5-16(13-17)22(23,24)25/h4-10,12-13H,2-3,11H2,1H3/b18-12-InChIKey
PYPZFSRAXAVWNH-PDGQHHTCSA-NSynonyms
butyl4((Z)(24dioxo3(3(trifluoromethyl)phenyl)13thiazolidin5ylidene)methyl)benzoate
CCCCOC(=O)C1=CC=C(C=C1)C=C2C(=O)N(C(=O)S2)C3=CC=CC(=C3)C(F)(F)F
CCCCOC(=O)c1ccc(cc1)C=C1SC(=O)N(C1=O)c1cccc(c1)C(F)(F)F
InChI=1SC22H18F3NO4Sc123113020(28)159714(81015)121819(27)26(21(29)3118)1764516(1317)22(2324)25h4101213H2311H21H3b1812
MFCD18192036
ZINC000027229703
ZINC27229703
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