Vitas-M small molecule compound
[(5Z)-4-oxo-5-{[1-phenyl-3-(4-propoxyphenyl)-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
Catalog ID
STK822884
SMILES CCCOc1ccc(cc1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CC(=O)O)c1ccccc1
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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 C24H21N3O4S2 MW 479.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O4S2/c1-2-12-31-19-10-8-16(9-11-19)22-17(14-27(25-22)18-6-4-3-5-7-18)13-20-23(30)26(15-21(28)29)24(32)33-20/h3-11,13-14H,2,12,15H2,1H3,(H,28,29)/b20-13-InChIKey
XEXNVVSSFLCAGS-MOSHPQCFSA-NSynonyms
((5Z)4oxo5((1phenyl3(4propoxyphenyl)1Hpyrazol4yl)methylidene)2thioxo13thiazolidin3yl)aceticacid
(Z)2(4oxo5((1phenyl3(4propoxyphenyl)1Hpyrazol4yl)methylene)2thioxothiazolidin3yl)aceticacid
2((5Z)4OXO5((1PHENYL3(4PROPOXYPHENYL)PYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
CCCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC(=O)O)C4=CC=CC=C4
CCCOc1ccc(cc1)c1nn(cc1C=C1SC(=S)N(C1=O)CC(=O)O)c1ccccc1
InChI=1SC24H21N3O4S2c1212311910816(91119)2217(1427(2522)186435718)132023(30)26(1521(28)29)24(32)3320h3111314H21215H21H3(H2829)b2013
MFCD02988080
ZINC000013799579
ZINC13799579
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