Vitas-M small molecule compound
[(5E)-5-(3-ethoxy-2-hydroxy-5-nitrobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
Catalog ID
STL428129
SMILES CCOc1cc(cc(c1O)/C=C\1/SC(=S)N(C1=O)CC(=O)O)[N+](=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 C14H12N2O7S2 MW 384.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N2O7S2/c1-2-23-9-5-8(16(21)22)3-7(12(9)19)4-10-13(20)15(6-11(17)18)14(24)25-10/h3-5,19H,2,6H2,1H3,(H,17,18)/b10-4+InChIKey
RMTNDJNGPDCERH-ONNFQVAWSA-NSynonyms
((5E)5(3ethoxy2hydroxy5nitrobenzylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
2((5E)5((3ETHOXY2HYDROXY5NITROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
2(5((3ETHOXY2HYDROXY5NITROPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
CCOC1=C(C(=CC(=C1)(N+)(=O)(O))C=C2C(=O)N(C(=S)S2)CC(=O)O)O
CCOc1cc(cc(c1O)C=C1SC(=S)N(C1=O)CC(=O)O)(N+)(=O)(O)
InChI=1SC14H12N2O7S2c1223958(16(21)22)37(12(9)19)41013(20)15(611(17)18)14(24)2510h3519H26H21H3(H1718)b104+
MFCD00644756
ZINC000036651842
ZINC36651842
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