Vitas-M small molecule compound
(5E)-5-{[(4-butylphenyl)amino]methylidene}-3-dodecyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK991443
SMILES CCCCCCCCCCCCN1C(=S)S/C(=C/Nc2ccc(cc2)CCCC)/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 C26H40N2OS2 MW 460.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H40N2OS2/c1-3-5-7-8-9-10-11-12-13-14-20-28-25(29)24(31-26(28)30)21-27-23-18-16-22(17-19-23)15-6-4-2/h16-19,21,27H,3-15,20H2,1-2H3/b24-21+InChIKey
LTDGKICMJUAAKR-DARPEHSRSA-NSynonyms
(5E)5(((4butylphenyl)amino)methylidene)3dodecyl2thioxo13thiazolidin4one
(5E)5((4butylanilino)methylidene)3dodecyl2sulfanylidene13thiazolidin4one
CCCCCCCCCCCCN1C(=O)C(=CNC2=CC=C(C=C2)CCCC)SC1=S
CCCCCCCCCCCCN1C(=S)SC(=CNc2ccc(cc2)CCCC)C1=O
InChI=1SC26H40N2OS2c1357891011121314202825(29)24(3126(28)30)212723181622(171923)15642h16192127H31520H212H3b2421+
MFCD07802001
ZINC000097961953
ZINC97961953
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