Vitas-M small molecule compound
(5Z)-3-pentyl-5-({1-phenyl-3-[4-(propan-2-yloxy)phenyl]-1H-pyrazol-4-yl}methylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK702581
SMILES CCCCCN1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2)OC(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 C27H29N3O2S2 MW 491.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O2S2/c1-4-5-9-16-29-26(31)24(34-27(29)33)17-21-18-30(22-10-7-6-8-11-22)28-25(21)20-12-14-23(15-13-20)32-19(2)3/h6-8,10-15,17-19H,4-5,9,16H2,1-3H3/b24-17-InChIKey
NMHHGXPIRIAXRD-ULJHMMPZSA-NSynonyms
(5Z)3pentyl5((1phenyl3(4(propan2yloxy)phenyl)1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3PENTYL5((1PHENYL3(4PROPAN2YLOXYPHENYL)PYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(4isopropoxyphenyl)1phenyl1Hpyrazol4yl)methylene)3pentyl2thioxothiazolidin4one
CCCCCN1C(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)OC(C)C)C4=CC=CC=C4)SC1=S
CCCCCN1C(=S)SC(=Cc2cn(nc2c2ccc(cc2)OC(C)C)c2ccccc2)C1=O
InChI=1SC27H29N3O2S2c1459162926(31)24(3427(29)33)17211830(22107681122)2825(21)20121423(151320)3219(2)3h6810151719H45916H213H3b2417
MFCD02986479
ZINC000002289524
ZINC02289524
ZINC2289524
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