Vitas-M small molecule compound
(5Z)-3-dodecyl-5-{[3-(3-fluoro-4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK813359
SMILES CCCCCCCCCCCCN1C(=S)S/C(=C\c2cn(nc2c2ccc(c(c2)F)C)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 C32H38FN3OS2 MW 563.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H38FN3OS2/c1-3-4-5-6-7-8-9-10-11-15-20-35-31(37)29(39-32(35)38)22-26-23-36(27-16-13-12-14-17-27)34-30(26)25-19-18-24(2)28(33)21-25/h12-14,16-19,21-23H,3-11,15,20H2,1-2H3/b29-22-InChIKey
DPNHBWLRKYLWOL-IADYIPOJSA-NSynonyms
(5Z)3dodecyl5((3(3fluoro4methylphenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3dodecyl5((3(3fluoro4methylphenyl)1phenylpyrazol4yl)methylidene)2sulfanylidene13thiazolidin4one
3DODECYL5((3(3FLUORO4METHYLPHENYL)1PHENYL1HPYRAZOL4YL)METHYLENE)2THIOXOTHIAZOLIDIN4ONE
CCCCCCCCCCCCN1C(=O)C(=CC2=CN(N=C2C3=CC(=C(C=C3)C)F)C4=CC=CC=C4)SC1=S
CCCCCCCCCCCCN1C(=S)SC(=Cc2cn(nc2c2ccc(c(c2)F)C)c2ccccc2)C1=O
InChI=1SC32H38FN3OS2c13456789101115203531(37)29(3932(35)38)22262336(27161312141727)3430(26)25191824(2)28(33)2125h121416192123H3111520H212H3b2922
MFCD04441512
ZINC000100871347
ZINC100871347
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