Vitas-M small molecule compound
(5Z)-5-({3-[4-(benzyloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-3-methyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK798427
SMILES CN1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2)OCc2ccccc2)c2ccccc2)/C1=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 C27H21N3O2S2 MW 483.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N3O2S2/c1-29-26(31)24(34-27(29)33)16-21-17-30(22-10-6-3-7-11-22)28-25(21)20-12-14-23(15-13-20)32-18-19-8-4-2-5-9-19/h2-17H,18H2,1H3/b24-16-InChIKey
NXFHZGPOUBDMBE-JLPGSUDCSA-NSynonyms
(5Z)3METHYL5((1PHENYL3(4PHENYLMETHOXYPHENYL)PYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5((3(4(benzyloxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)3methyl2thioxo13thiazolidin4one
CN1C(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)OCC4=CC=CC=C4)C5=CC=CC=C5)SC1=S
CN1C(=S)SC(=Cc2cn(nc2c2ccc(cc2)OCc2ccccc2)c2ccccc2)C1=O
InChI=1SC27H21N3O2S2c12926(31)24(3427(29)33)16211730(22106371122)2825(21)20121423(151320)3218198425919h217H18H21H3b2416
MFCD03417682
ZINC000002666025
ZINC02666025
ZINC2666025
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