Vitas-M small molecule compound
4-{(5Z)-5-[(3-{3-[(4-fluorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}butanoic acid
Catalog ID
STK556485
SMILES OC(=O)CCCN1C(=S)S/C(=C\c2cn(nc2c2cccc(c2)OCc2ccc(cc2)F)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 C30H24FN3O4S2 MW 573.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24FN3O4S2/c31-23-13-11-20(12-14-23)19-38-25-9-4-6-21(16-25)28-22(18-34(32-28)24-7-2-1-3-8-24)17-26-29(37)33(30(39)40-26)15-5-10-27(35)36/h1-4,6-9,11-14,16-18H,5,10,15,19H2,(H,35,36)/b26-17-InChIKey
GMXSTAJUVZMRHB-ONUIUJJFSA-NSynonyms
(Z)4(5((3(3((4fluorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)methylene)4oxo2thioxothiazolidin3yl)butanoicacid
4((5Z)5((3(3((4fluorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)4oxo2thioxo13thiazolidin3yl)butanoicacid
4((5Z)5((3(3((4FLUOROPHENYL)METHOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOICACID
C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)OCC4=CC=C(C=C4)F)C=C5C(=O)N(C(=S)S5)CCCC(=O)O
InChI=1SC30H24FN3O4S2c3123131120(121423)19382594621(1625)2822(1834(3228)247213824)172629(37)33(30(39)4026)1551027(35)36h146911141618H5101519H2(H3536)b2617
MFCD04018279
OC(=O)CCCN1C(=S)SC(=Cc2cn(nc2c2cccc(c2)OCc2ccc(cc2)F)c2ccccc2)C1=O
ZINC000097947612
ZINC000102474315
ZINC97947612
Check stock
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Check stock on Vitas-MAvailable files
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