Vitas-M small molecule compound
3-(5-{(Z)-[3-(2-chloro-6-fluorobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)-4-methylbenzoic acid
Catalog ID
STL379098
SMILES OC(=O)c1ccc(c(c1)c1ccc(o1)/C=C/1\SC(=O)N(C1=O)Cc1c(F)cccc1Cl)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 C23H15ClFNO5S MW 471.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15ClFNO5S/c1-12-5-6-13(22(28)29)9-15(12)19-8-7-14(31-19)10-20-21(27)26(23(30)32-20)11-16-17(24)3-2-4-18(16)25/h2-10H,11H2,1H3,(H,28,29)/b20-10-InChIKey
LLPQMDQELBZTOT-JMIUGGIZSA-NSynonyms
3(5((Z)(3((2CHLORO6FLUOROPHENYL)METHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)FURAN2YL)4METHYLBENZOICACID
3(5((Z)(3(2chloro6fluorobenzyl)24dioxo13thiazolidin5ylidene)methyl)furan2yl)4methylbenzoicacid
CC1=C(C=C(C=C1)C(=O)O)C2=CC=C(O2)C=C3C(=O)N(C(=O)S3)CC4=C(C=CC=C4Cl)F
InChI=1SC23H15ClFNO5Sc1125613(22(28)29)915(12)198714(3119)102021(27)26(23(30)3220)111617(24)32418(16)25h210H11H21H3(H2829)b2010
MFCD07084607
OC(=O)c1ccc(c(c1)c1ccc(o1)C=C1SC(=O)N(C1=O)Cc1c(F)cccc1Cl)C
ZINC000033337548
ZINC33337548
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