Vitas-M small molecule compound
3-{(5Z)-5-[1-(2-fluorobenzyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}propanoic acid
Catalog ID
STK702015
SMILES OC(=O)CCN1C(=S)S/C(=C\2/c3ccccc3N(C2=O)Cc2ccccc2F)/C1=O
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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 C21H15FN2O4S2 MW 442.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15FN2O4S2/c22-14-7-3-1-5-12(14)11-24-15-8-4-2-6-13(15)17(19(24)27)18-20(28)23(21(29)30-18)10-9-16(25)26/h1-8H,9-11H2,(H,25,26)/b18-17-InChIKey
JBBAOAQVQHVPRZ-ZCXUNETKSA-NSynonyms
3((5Z)5(1((2FLUOROPHENYL)METHYL)2OXOINDOL3YLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
3((5Z)5(1(2fluorobenzyl)2oxo12dihydro3Hindol3ylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
C1=CC=C(C(=C1)CN2C3=CC=CC=C3C(=C4C(=O)N(C(=S)S4)CCC(=O)O)C2=O)F
InChI=1SC21H15FN2O4S2c2214731512(14)112415842613(15)17(19(24)27)1820(28)23(21(29)3018)10916(25)26h18H911H2(H2526)b1817
MFCD03225651
OC(=O)CCN1C(=S)SC(=C2c3ccccc3N(C2=O)Cc2ccccc2F)C1=O
ZINC000016699668
ZINC16699668
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