Vitas-M small molecule compound
(5Z)-3-(butan-2-yl)-5-{[3-(4-butoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK813746
SMILES CCCCOc1ccc(cc1C)c1nn(cc1/C=C/1\SC(=S)N(C1=O)C(CC)C)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 C28H31N3O2S2 MW 505.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O2S2/c1-5-7-15-33-24-14-13-21(16-19(24)3)26-22(18-30(29-26)23-11-9-8-10-12-23)17-25-27(32)31(20(4)6-2)28(34)35-25/h8-14,16-18,20H,5-7,15H2,1-4H3/b25-17-InChIKey
HXQHZCLDQCKOOU-UQQQWYQISA-NSynonyms
(5Z)3(butan2yl)5((3(4butoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3BUTAN2YL5((3(4BUTOXY3METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(4butoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylene)3(secbutyl)2thioxothiazolidin4one
5((3(4BUTOXY3METHYLPHENYL)1PHENYL1HPYRAZOL4YL)METHYLENE)3(SECBUTYL)2THIOXOTHIAZOLIDIN4ONE
CCCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)C(C)CC)C4=CC=CC=C4)C
CCCCOc1ccc(cc1C)c1nn(cc1C=C1SC(=S)N(C1=O)C(CC)C)c1ccccc1
InChI=1SC28H31N3O2S2c157153324141321(1619(24)3)2622(1830(2926)231198101223)172527(32)31(20(4)62)28(34)3525h814161820H5715H214H3b2517
MFCD03667189
ZINC000002378214
ZINC000002378216
Check stock
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Check stock on Vitas-MAvailable files
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