Vitas-M small molecule compound
(5Z)-5-{[3-(4-butoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(4-fluorobenzyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK813463
SMILES CCCCOc1ccc(cc1C)c1nn(cc1/C=C/1\SC(=S)N(C1=O)Cc1ccc(cc1)F)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 C31H28FN3O2S2 MW 557.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28FN3O2S2/c1-3-4-16-37-27-15-12-23(17-21(27)2)29-24(20-35(33-29)26-8-6-5-7-9-26)18-28-30(36)34(31(38)39-28)19-22-10-13-25(32)14-11-22/h5-15,17-18,20H,3-4,16,19H2,1-2H3/b28-18-InChIKey
GHHZNCCVHMXVES-VEILYXNESA-NSynonyms
(5Z)5((3(4butoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylidene)3(4fluorobenzyl)2thioxo13thiazolidin4one
(5Z)5((3(4BUTOXY3METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3((4FLUOROPHENYL)METHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
5((3(4BUTOXY3METHYLPHENYL)1PHENYL1HPYRAZOL4YL)METHYLENE)3(4FLUOROBENZYL)2THIOXOTHIAZOLIDIN4ONE
CCCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC4=CC=C(C=C4)F)C5=CC=CC=C5)C
CCCCOc1ccc(cc1C)c1nn(cc1C=C1SC(=S)N(C1=O)Cc1ccc(cc1)F)c1ccccc1
InChI=1SC31H28FN3O2S2c134163727151223(1721(27)2)2924(2035(3329)268657926)182830(36)34(31(38)3928)1922101325(32)141122h515171820H341619H212H3b2818
MFCD04441583
ZINC000100871482
ZINC100871482
Check stock
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Check stock on Vitas-MAvailable files
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