Vitas-M small molecule compound
(5Z)-5-{[3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-pentyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK797041
SMILES CCCCCN1C(=S)S/C(=C\c2cn(nc2c2ccc(c(c2)C)OCC)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/c1-4-6-10-15-29-26(31)24(34-27(29)33)17-21-18-30(22-11-8-7-9-12-22)28-25(21)20-13-14-23(32-5-2)19(3)16-20/h7-9,11-14,16-18H,4-6,10,15H2,1-3H3/b24-17-InChIKey
GWVZLZTZTSNXEN-ULJHMMPZSA-NSynonyms
(5Z)5((3(4ethoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylidene)3pentyl2thioxo13thiazolidin4one
(5Z)5((3(4ETHOXY3METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3PENTYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(4ethoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylene)3pentyl2thioxothiazolidin4one
CCCCCN1C(=O)C(=CC2=CN(N=C2C3=CC(=C(C=C3)OCC)C)C4=CC=CC=C4)SC1=S
CCCCCN1C(=S)SC(=Cc2cn(nc2c2ccc(c(c2)C)OCC)c2ccccc2)C1=O
InChI=1SC27H29N3O2S2c14610152926(31)24(3427(29)33)17211830(22118791222)2825(21)20131423(3252)19(3)1620h7911141618H461015H213H3b2417
MFCD02988577
ZINC000002216955
ZINC02216955
ZINC2216955
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