Vitas-M small molecule compound
(5E)-3-cyclohexyl-5-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL428488
SMILES COc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/SC(=S)N(C1=O)C1CCCCC1
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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 C23H26N2O2S2 MW 426.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2O2S2/c1-15-13-17(16(2)24(15)19-9-11-20(27-3)12-10-19)14-21-22(26)25(23(28)29-21)18-7-5-4-6-8-18/h9-14,18H,4-8H2,1-3H3/b21-14+InChIKey
QBJMZHRUZBMGJF-KGENOOAVSA-NSynonyms
(5E)3cyclohexyl5((1(4methoxyphenyl)25dimethyl1Hpyrrol3yl)methylidene)2thioxo13thiazolidin4one
(5E)3CYCLOHEXYL5((1(4METHOXYPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C=C3C(=O)N(C(=S)S3)C4CCCCC4
COc1ccc(cc1)n1c(C)cc(c1C)C=C1SC(=S)N(C1=O)C1CCCCC1
InChI=1SC23H26N2O2S2c1151317(16(2)24(15)1991120(273)121019)142122(26)25(23(28)2921)187546818h91418H48H213H3b2114+
MFCD03706686
ZINC000001151146
ZINC01151146
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