Vitas-M small molecule compound
3-[(5E)-5-(4-chloro-3-nitrobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid
Catalog ID
STL297105
SMILES OC(=O)CCN1C(=S)S/C(=C/c2ccc(c(c2)[N+](=O)[O-])Cl)/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 C13H9ClN2O5S2 MW 372.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9ClN2O5S2/c14-8-2-1-7(5-9(8)16(20)21)6-10-12(19)15(13(22)23-10)4-3-11(17)18/h1-2,5-6H,3-4H2,(H,17,18)/b10-6+InChIKey
ISFMWGVYKQJBLY-UXBLZVDNSA-NSynonyms
302949-50-4(E)3(5(4chloro3nitrobenzylidene)4oxo2thioxothiazolidin3yl)propanoicacid
3((5E)5((4CHLORO3NITROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
3((5E)5(4chloro3nitrobenzylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
302949504
C1=CC(=C(C=C1C=C2C(=O)N(C(=S)S2)CCC(=O)O)(N+)(=O)(O))Cl
InChI=1SC13H9ClN2O5S2c148217(59(8)16(20)21)61012(19)15(13(22)2310)4311(17)18h1256H34H2(H1718)b106+
MFCD03000785
OC(=O)CCN1C(=S)SC(=Cc2ccc(c(c2)(N+)(=O)(O))Cl)C1=O
ZINC000001771532
ZINC1771532
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