Vitas-M small molecule compound
2-hydroxy-5-[(5E)-4-oxo-5-(pyridin-4-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]benzoic acid
Catalog ID
STL035777
SMILES S=C1S/C(=C/c2ccncc2)/C(=O)N1c1ccc(c(c1)C(=O)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 C16H10N2O4S2 MW 358.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10N2O4S2/c19-12-2-1-10(8-11(12)15(21)22)18-14(20)13(24-16(18)23)7-9-3-5-17-6-4-9/h1-8,19H,(H,21,22)/b13-7+InChIKey
BPZWBCDGHZNNPL-NTUHNPAUSA-NSynonyms
2hydroxy5((5E)4oxo5(pyridin4ylmethylidene)2sulfanylidene13thiazolidin3yl)benzoicacid
2hydroxy5((5E)4oxo5(pyridin4ylmethylidene)2thioxo13thiazolidin3yl)benzoicacid
C1=CC(=C(C=C1N2C(=O)C(=CC3=CC=NC=C3)SC2=S)C(=O)O)O
InChI=1SC16H10N2O4S2c19122110(811(12)15(21)22)1814(20)13(2416(18)23)793517649h1819H(H2122)b137+
MFCD18192159
S=C1SC(=Cc2ccncc2)C(=O)N1c1ccc(c(c1)C(=O)O)O
ZINC000027530453
ZINC27530453
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