Vitas-M small molecule compound
(5Z)-5-({3-[3-methyl-4-(3-methylbutoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-3-pentyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK703019
SMILES CCCCCN1C(=S)S/C(=C\c2cn(nc2c2ccc(c(c2)C)OCCC(C)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 C30H35N3O2S2 MW 533.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H35N3O2S2/c1-5-6-10-16-32-29(34)27(37-30(32)36)19-24-20-33(25-11-8-7-9-12-25)31-28(24)23-13-14-26(22(4)18-23)35-17-15-21(2)3/h7-9,11-14,18-21H,5-6,10,15-17H2,1-4H3/b27-19-InChIKey
CFOXEJRBEWUNRU-DIBXZPPDSA-NSynonyms
(5Z)5((3(3methyl4(3methylbutoxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)3pentyl2thioxo13thiazolidin4one
(5Z)5((3(3methyl4(3methylbutoxy)phenyl)1phenylpyrazol4yl)methylidene)3pentyl2sulfanylidene13thiazolidin4one
(Z)5((3(4(isopentyloxy)3methylphenyl)1phenyl1Hpyrazol4yl)methylene)3pentyl2thioxothiazolidin4one
CCCCCN1C(=O)C(=CC2=CN(N=C2C3=CC(=C(C=C3)OCCC(C)C)C)C4=CC=CC=C4)SC1=S
CCCCCN1C(=S)SC(=Cc2cn(nc2c2ccc(c(c2)C)OCCC(C)C)c2ccccc2)C1=O
InChI=1SC30H35N3O2S2c15610163229(34)27(3730(32)36)19242033(25118791225)3128(24)23131426(22(4)1823)35171521(2)3h7911141821H56101517H214H3b2719
MFCD02995108
ZINC000009435894
ZINC09435894
ZINC9435894
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