Vitas-M small molecule compound
(5Z)-3-dodecyl-5-({3-[2-methyl-4-(prop-2-en-1-yloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK813464
SMILES CCCCCCCCCCCCN1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2C)OCC=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 C35H43N3O2S2 MW 601.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H43N3O2S2/c1-4-6-7-8-9-10-11-12-13-17-22-37-34(39)32(42-35(37)41)25-28-26-38(29-18-15-14-16-19-29)36-33(28)31-21-20-30(24-27(31)3)40-23-5-2/h5,14-16,18-21,24-26H,2,4,6-13,17,22-23H2,1,3H3/b32-25-InChIKey
RCOKTURCDKQJBI-MKCFTUBBSA-NSynonyms
(5Z)3dodecyl5((3(2methyl4(prop2en1yloxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3dodecyl5((3(2methyl4prop2enoxyphenyl)1phenylpyrazol4yl)methylidene)2sulfanylidene13thiazolidin4one
5((3(4(ALLYLOXY)2METHYLPHENYL)1PHENYL1HPYRAZOL4YL)METHYLENE)3DODECYL2THIOXOTHIAZOLIDIN4ONE
CCCCCCCCCCCCN1C(=O)C(=CC2=CN(N=C2C3=C(C=C(C=C3)OCC=C)C)C4=CC=CC=C4)SC1=S
CCCCCCCCCCCCN1C(=S)SC(=Cc2cn(nc2c2ccc(cc2C)OCC=C)c2ccccc2)C1=O
InChI=1SC35H43N3O2S2c1467891011121317223734(39)32(4235(37)41)25282638(29181514161929)3633(28)31212030(2427(31)3)402352h5141618212426H24613172223H213H3b3225
MFCD04441584
ZINC000100871483
ZINC100871483
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