Vitas-M small molecule compound
(5Z)-5-{[3-(3-methyl-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK703010
SMILES CCCOc1ccc(cc1C)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CC1CCCO1)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 C28H29N3O3S2 MW 519.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O3S2/c1-3-13-34-24-12-11-20(15-19(24)2)26-21(17-31(29-26)22-8-5-4-6-9-22)16-25-27(32)30(28(35)36-25)18-23-10-7-14-33-23/h4-6,8-9,11-12,15-17,23H,3,7,10,13-14,18H2,1-2H3/b25-16-InChIKey
LRKXGNLGTWSHCG-XYGWBWBKSA-NSynonyms
(5Z)5((3(3methyl4propoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)3(tetrahydrofuran2ylmethyl)2thioxo13thiazolidin4one
(5Z)5((3(3METHYL4PROPOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3(OXOLAN2YLMETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(3methyl4propoxyphenyl)1phenyl1Hpyrazol4yl)methylene)3((tetrahydrofuran2yl)methyl)2thioxothiazolidin4one
CCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC4CCCO4)C5=CC=CC=C5)C
CCCOc1ccc(cc1C)c1nn(cc1C=C1SC(=S)N(C1=O)CC1CCCO1)c1ccccc1
InChI=1SC28H29N3O3S2c13133424121120(1519(24)2)2621(1731(2926)228546922)162527(32)30(28(35)3625)1823107143323h46891112151723H3710131418H212H3b2516
MFCD02988404
ZINC000002216292
ZINC000002216296
Check stock
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Check stock on Vitas-MAvailable files
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