Vitas-M small molecule compound
(5Z)-5-[(3-{4-[(2-fluorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)methylidene]-3-(furan-2-ylmethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK798521
SMILES S=C1S/C(=C\c2cn(nc2c2ccc(cc2)OCc2ccccc2F)c2ccccc2)/C(=O)N1Cc1ccco1
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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 C31H22FN3O3S2 MW 567.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H22FN3O3S2/c32-27-11-5-4-7-22(27)20-38-25-14-12-21(13-15-25)29-23(18-35(33-29)24-8-2-1-3-9-24)17-28-30(36)34(31(39)40-28)19-26-10-6-16-37-26/h1-18H,19-20H2/b28-17-InChIKey
BXUVCTWFVDFGHV-QRQIAZFYSA-NSynonyms
(5Z)5((3(4((2fluorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)3(furan2ylmethyl)2thioxo13thiazolidin4one
(5Z)5((3(4((2FLUOROPHENYL)METHOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3(FURAN2YLMETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4F)C=C5C(=O)N(C(=S)S5)CC6=CC=CO6
InChI=1SC31H22FN3O3S2c32271154722(27)203825141221(131525)2923(1835(3329)248213924)172830(36)34(31(39)4028)1926106163726h118H1920H2b2817
MFCD03417725
S=C1SC(=Cc2cn(nc2c2ccc(cc2)OCc2ccccc2F)c2ccccc2)C(=O)N1Cc1ccco1
ZINC000100838938
ZINC100838938
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