Vitas-M small molecule compound
(5Z)-5-{[3-(4-butoxy-3-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(2-methoxyethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK706632
SMILES CCCCOc1ccc(cc1Cl)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CCOC)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 C26H26ClN3O3S2 MW 528.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClN3O3S2/c1-3-4-13-33-22-11-10-18(15-21(22)27)24-19(17-30(28-24)20-8-6-5-7-9-20)16-23-25(31)29(12-14-32-2)26(34)35-23/h5-11,15-17H,3-4,12-14H2,1-2H3/b23-16-InChIKey
SGPITDOFVZQKHX-KQWNVCNZSA-NSynonyms
1009436-30-9(5Z)5((3(4butoxy3chlorophenyl)1phenyl1Hpyrazol4yl)methylidene)3(2methoxyethyl)2thioxo13thiazolidin4one
(5Z)5((3(4BUTOXY3CHLOROPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3(2METHOXYETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(4butoxy3chlorophenyl)1phenyl1Hpyrazol4yl)methylene)3(2methoxyethyl)2thioxothiazolidin4one
1009436309
CCCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCOC)C4=CC=CC=C4)Cl
CCCCOc1ccc(cc1Cl)c1nn(cc1C=C1SC(=S)N(C1=O)CCOC)c1ccccc1
InChI=1SC26H26ClN3O3S2c134133322111018(1521(22)27)2419(1730(2824)208657920)162325(31)29(1214322)26(34)3523h5111517H341214H212H3b2316
MFCD04006189
ZINC000101030505
ZINC101030505
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