Vitas-M small molecule compound
6-[(5Z)-5-{[3-(3-butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoic acid
Catalog ID
STK706806
SMILES CCCCOc1cccc(c1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CCCCCC(=O)O)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 C29H31N3O4S2 MW 549.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O4S2/c1-2-3-17-36-24-14-10-11-21(18-24)27-22(20-32(30-27)23-12-6-4-7-13-23)19-25-28(35)31(29(37)38-25)16-9-5-8-15-26(33)34/h4,6-7,10-14,18-20H,2-3,5,8-9,15-17H2,1H3,(H,33,34)/b25-19-InChIKey
DKJUIPAKCKMBOS-PLRJNAJWSA-NSynonyms
1009189-77-8(Z)6(5((3(3butoxyphenyl)1phenyl1Hpyrazol4yl)methylene)4oxo2thioxothiazolidin3yl)hexanoicacid
1009189778
6((5Z)5((3(3butoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)4oxo2thioxo13thiazolidin3yl)hexanoicacid
6((5Z)5((3(3BUTOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)HEXANOICACID
CCCCOC1=CC=CC(=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCCCCC(=O)O)C4=CC=CC=C4
CCCCOc1cccc(c1)c1nn(cc1C=C1SC(=S)N(C1=O)CCCCCC(=O)O)c1ccccc1
InChI=1SC29H31N3O4S2c12317362414101121(1824)2722(2032(3027)23126471323)192528(35)31(29(37)3825)169581526(33)34h46710141820H235891517H21H3(H3334)b2519
MFCD04022543
ZINC000101065303
ZINC101065303
Check stock
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Check stock on Vitas-MAvailable files
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