Vitas-M small molecule compound
2-[(5E)-5-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanedioic acid
Catalog ID
STL017910
SMILES OC(=O)C(N1C(=S)S/C(=C/c2ccc(o2)c2ccc(cc2)F)/C1=O)CC(=O)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 C18H12FNO6S2 MW 421.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12FNO6S2/c19-10-3-1-9(2-4-10)13-6-5-11(26-13)7-14-16(23)20(18(27)28-14)12(17(24)25)8-15(21)22/h1-7,12H,8H2,(H,21,22)(H,24,25)/b14-7+InChIKey
PDHJTFCMQRRNGE-VGOFMYFVSA-NSynonyms
2((5E)5((5(4fluorophenyl)furan2yl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)butanedioicacid
2((5E)5((5(4fluorophenyl)furan2yl)methylidene)4oxo2thioxo13thiazolidin3yl)butanedioicacid
C1=CC(=CC=C1C2=CC=C(O2)C=C3C(=O)N(C(=S)S3)C(CC(=O)O)C(=O)O)F
InChI=1SC18H12FNO6S2c1910319(2410)136511(2613)71416(23)20(18(27)2814)12(17(24)25)815(21)22h1712H8H2(H2122)(H2425)b147+
MFCD07998445
OC(=O)C(N1C(=S)SC(=Cc2ccc(o2)c2ccc(cc2)F)C1=O)CC(=O)O
ZINC000008884274
ZINC000008884277
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