Vitas-M small molecule compound
2-{(5E)-5-[(1-methyl-1H-pyrrol-2-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid
Catalog ID
STL035562
SMILES OC(=O)C(N1C(=S)S/C(=C/c2cccn2C)/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 C18H16N2O3S2 MW 372.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O3S2/c1-19-9-5-8-13(19)11-15-16(21)20(18(24)25-15)14(17(22)23)10-12-6-3-2-4-7-12/h2-9,11,14H,10H2,1H3,(H,22,23)/b15-11+InChIKey
KJCWFFVOKRNCEF-RVDMUPIBSA-NSynonyms
(Z)2(5((1methyl1Hpyrrol2yl)methylene)4oxo2thioxothiazolidin3yl)3phenylpropanoicacid
2((5E)5((1methyl1Hpyrrol2yl)methylidene)4oxo2thioxo13thiazolidin3yl)3phenylpropanoicacid
2((5E)5((1methylpyrrol2yl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)3phenylpropanoicacid
CN1C=CC=C1C=C2C(=O)N(C(=S)S2)C(CC3=CC=CC=C3)C(=O)O
InChI=1SC18H16N2O3S2c11995813(19)111516(21)20(18(24)2515)14(17(22)23)10126324712h291114H10H21H3(H2223)b1511+
MFCD18192030
OC(=O)C(N1C(=S)SC(=Cc2cccn2C)C1=O)Cc1ccccc1
ZINC000002333100
ZINC000002333105
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