Vitas-M small molecule compound
(5E)-5-(4-ethylbenzylidene)-3-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK994288
SMILES CCc1ccc(cc1)/C=C\1/SC(=S)N(C1=O)CCC(=O)N1CCN(CC1)C
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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 C20H25N3O2S2 MW 403.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O2S2/c1-3-15-4-6-16(7-5-15)14-17-19(25)23(20(26)27-17)9-8-18(24)22-12-10-21(2)11-13-22/h4-7,14H,3,8-13H2,1-2H3/b17-14+InChIKey
VQNITLUVCOFHPJ-SAPNQHFASA-NSynonyms
(5E)5((4ETHYLPHENYL)METHYLIDENE)3(3(4METHYLPIPERAZIN1YL)3OXOPROPYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5E)5(4ethylbenzylidene)3(3(4methylpiperazin1yl)3oxopropyl)2thioxo13thiazolidin4one
CCC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)N3CCN(CC3)C
CCc1ccc(cc1)C=C1SC(=S)N(C1=O)CCC(=O)N1CCN(CC1)C
InChI=1SC20H25N3O2S2c13154616(7515)141719(25)23(20(26)2717)9818(24)22121021(2)111322h4714H3813H212H3b1714+
MFCD18185060
ZINC000033323832
ZINC33323832
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