Vitas-M small molecule compound
6-[(5E)-5-{[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoic acid
Catalog ID
STK994930
SMILES OC(=O)CCCCCN1C(=S)S/C(=C/c2ccc(o2)c2ccc(cc2Cl)[N+](=O)[O-])/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 C20H17ClN2O6S2 MW 480.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN2O6S2/c21-15-10-12(23(27)28)5-7-14(15)16-8-6-13(29-16)11-17-19(26)22(20(30)31-17)9-3-1-2-4-18(24)25/h5-8,10-11H,1-4,9H2,(H,24,25)/b17-11+InChIKey
UFSDZZRMTWSKRC-GZTJUZNOSA-NSynonyms
6((5E)5((5(2CHLORO4NITROPHENYL)FURAN2YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)HEXANOICACID
6((5E)5((5(2chloro4nitrophenyl)furan2yl)methylidene)4oxo2thioxo13thiazolidin3yl)hexanoicacid
C1=CC(=C(C=C1(N+)(=O)(O))Cl)C2=CC=C(O2)C=C3C(=O)N(C(=S)S3)CCCCCC(=O)O
InChI=1SC20H17ClN2O6S2c21151012(23(27)28)5714(15)168613(2916)111719(26)22(20(30)3117)9312418(24)25h581011H149H2(H2425)b1711+
MFCD04065176
OC(=O)CCCCCN1C(=S)SC(=Cc2ccc(o2)c2ccc(cc2Cl)(N+)(=O)(O))C1=O
ZINC000001805126
ZINC1805126
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