Vitas-M small molecule compound
(5Z)-3-(3-methoxypropyl)-5-({3-[3-methyl-4-(propan-2-yloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK702950
SMILES COCCCN1C(=S)S/C(=C\c2cn(nc2c2ccc(c(c2)C)OC(C)C)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 C27H29N3O3S2 MW 507.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O3S2/c1-18(2)33-23-12-11-20(15-19(23)3)25-21(17-30(28-25)22-9-6-5-7-10-22)16-24-26(31)29(27(34)35-24)13-8-14-32-4/h5-7,9-12,15-18H,8,13-14H2,1-4H3/b24-16-InChIKey
UGKHMDUNLVRGJP-JLPGSUDCSA-NSynonyms
(5Z)3(3methoxypropyl)5((3(3methyl4(propan2yloxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3(3METHOXYPROPYL)5((3(3METHYL4PROPAN2YLOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(4isopropoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylene)3(3methoxypropyl)2thioxothiazolidin4one
CC1=C(C=CC(=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCCOC)C4=CC=CC=C4)OC(C)C
COCCCN1C(=S)SC(=Cc2cn(nc2c2ccc(c(c2)C)OC(C)C)c2ccccc2)C1=O
InChI=1SC27H29N3O3S2c118(2)3323121120(1519(23)3)2521(1730(2825)2296571022)162426(31)29(27(34)3524)13814324h579121518H81314H214H3b2416
MFCD02987015
ZINC000002355877
ZINC02355877
ZINC2355877
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.