Vitas-M small molecule compound
2-{(5E)-5-[(1-methyl-1H-pyrazol-4-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid
Catalog ID
STL401752
SMILES OC(=O)C(N1C(=S)S/C(=C/c2cnn(c2)C)/C1=O)Cc1ccccc1
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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 C17H15N3O3S2 MW 373.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N3O3S2/c1-19-10-12(9-18-19)8-14-15(21)20(17(24)25-14)13(16(22)23)7-11-5-3-2-4-6-11/h2-6,8-10,13H,7H2,1H3,(H,22,23)/b14-8+InChIKey
GVZBHRZSOCGTMA-RIYZIHGNSA-NSynonyms
1092799-21-71092799217
2((5E)5((1methyl1Hpyrazol4yl)methylidene)4oxo2thioxo13thiazolidin3yl)3phenylpropanoicacid
2((5E)5((1methylpyrazol4yl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)3phenylpropanoicacid
CN1C=C(C=N1)C=C2C(=O)N(C(=S)S2)C(CC3=CC=CC=C3)C(=O)O
InChI=1SC17H15N3O3S2c1191012(91819)81415(21)20(17(24)2514)13(16(22)23)7115324611h2681013H7H21H3(H2223)b148+
MFCD04136597
OC(=O)C(N1C(=S)SC(=Cc2cnn(c2)C)C1=O)Cc1ccccc1
ZINC000002807803
ZINC000002807805
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