Vitas-M small molecule compound
[(5E)-5-{2-[(4-nitrobenzyl)oxy]benzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
Catalog ID
STL428121
SMILES OC(=O)CN1C(=S)S/C(=C/c2ccccc2OCc2ccc(cc2)[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 C19H14N2O6S2 MW 430.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14N2O6S2/c22-17(23)10-20-18(24)16(29-19(20)28)9-13-3-1-2-4-15(13)27-11-12-5-7-14(8-6-12)21(25)26/h1-9H,10-11H2,(H,22,23)/b16-9+InChIKey
YRNZNBUYBPDJFQ-CXUHLZMHSA-NSynonyms
((5E)5(2((4nitrobenzyl)oxy)benzylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
2((5E)5((2((4nitrophenyl)methoxy)phenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)aceticacid
C1=CC=C(C(=C1)C=C2C(=O)N(C(=S)S2)CC(=O)O)OCC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC19H14N2O6S2c2217(23)102018(24)16(2919(20)28)913312415(13)2711125714(8612)21(25)26h19H1011H2(H2223)b169+
MFCD01963648
OC(=O)CN1C(=S)SC(=Cc2ccccc2OCc2ccc(cc2)(N+)(=O)(O))C1=O
ZINC000009296614
ZINC9296614
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