Vitas-M small molecule compound
2-[(5E)-4-oxo-5-(quinolin-6-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]-3-phenylpropanoic acid
Catalog ID
STK622001
SMILES OC(=O)C(N1C(=S)S/C(=C/c2ccc3c(c2)cccn3)/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 C22H16N2O3S2 MW 420.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N2O3S2/c25-20-19(13-15-8-9-17-16(11-15)7-4-10-23-17)29-22(28)24(20)18(21(26)27)12-14-5-2-1-3-6-14/h1-11,13,18H,12H2,(H,26,27)/b19-13+InChIKey
IVFMKTUAYIQIGK-CPNJWEJPSA-NSynonyms
(E)2(4oxo5(quinolin6ylmethylene)2thioxothiazolidin3yl)3phenylpropanoicacid
2((5E)4oxo5(quinolin6ylmethylidene)2sulfanylidene13thiazolidin3yl)3phenylpropanoicacid
2((5E)4oxo5(quinolin6ylmethylidene)2thioxo13thiazolidin3yl)3phenylpropanoicacid
C1=CC=C(C=C1)CC(C(=O)O)N2C(=O)C(=CC3=CC4=C(C=C3)N=CC=C4)SC2=S
InChI=1SC22H16N2O3S2c252019(1315891716(1115)74102317)2922(28)24(20)18(21(26)27)12145213614h1111318H12H2(H2627)b1913+
MFCD09790969
OC(=O)C(N1C(=S)SC(=Cc2ccc3c(c2)cccn3)C1=O)Cc1ccccc1
ZINC000008993248
ZINC000008993249
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