Vitas-M small molecule compound
11-[(5E)-5-{[4-(ethoxycarbonyl)piperazin-1-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]undecanoic acid
Catalog ID
STK991777
SMILES CCOC(=O)N1CCN(CC1)/C=C\1/SC(=S)N(C1=O)CCCCCCCCCCC(=O)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 C22H35N3O5S2 MW 485.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H35N3O5S2/c1-2-30-21(29)24-15-13-23(14-16-24)17-18-20(28)25(22(31)32-18)12-10-8-6-4-3-5-7-9-11-19(26)27/h17H,2-16H2,1H3,(H,26,27)/b18-17+InChIKey
IQPUSDYVKIJKGW-ISLYRVAYSA-NSynonyms
929854-66-0(E)11(5((4(ethoxycarbonyl)piperazin1yl)methylene)4oxo2thioxothiazolidin3yl)undecanoicacid
11((5E)5((4(ethoxycarbonyl)piperazin1yl)methylidene)4oxo2thioxo13thiazolidin3yl)undecanoicacid
11((5E)5((4ethoxycarbonylpiperazin1yl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)undecanoicacid
929854660
CCOC(=O)N1CCN(CC1)C=C1SC(=S)N(C1=O)CCCCCCCCCCC(=O)O
CCOC(=O)N1CCN(CC1)C=C2C(=O)N(C(=S)S2)CCCCCCCCCCC(=O)O
InChI=1SC22H35N3O5S2c123021(29)24151323(141624)171820(28)25(22(31)3218)121086435791119(26)27h17H216H21H3(H2627)b1817+
MFCD09845537
ZINC000009530507
ZINC9530507
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