Vitas-M small molecule compound
(5Z)-5-({3-[4-(hexyloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-3-(3-methoxypropyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK799016
SMILES CCCCCCOc1ccc(cc1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CCCOC)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 C29H33N3O3S2 MW 535.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N3O3S2/c1-3-4-5-9-19-35-25-15-13-22(14-16-25)27-23(21-32(30-27)24-11-7-6-8-12-24)20-26-28(33)31(29(36)37-26)17-10-18-34-2/h6-8,11-16,20-21H,3-5,9-10,17-19H2,1-2H3/b26-20-InChIKey
PEGSZPYSFMELTP-QOMWVZHYSA-NSynonyms
955888-94-5(5Z)5((3(4(hexyloxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)3(3methoxypropyl)2thioxo13thiazolidin4one
(5Z)5((3(4HEXOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3(3METHOXYPROPYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(4(hexyloxy)phenyl)1phenyl1Hpyrazol4yl)methylene)3(3methoxypropyl)2thioxothiazolidin4one
955888945
CCCCCCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCCOC)C4=CC=CC=C4
CCCCCCOc1ccc(cc1)c1nn(cc1C=C1SC(=S)N(C1=O)CCCOC)c1ccccc1
InChI=1SC29H33N3O3S2c13459193525151322(141625)2723(2132(3027)24117681224)202628(33)31(29(36)3726)171018342h6811162021H359101719H212H3b2620
MFCD03462202
ZINC000100839665
ZINC100839665
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