Vitas-M small molecule compound

butyl 3-{(5E)-5-[3-(3-butoxy-3-oxopropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}propanoate

Catalog ID
STL307677
SMILES CCCCOC(=O)CCN1C(=S)S/C(=C\2/SC(=S)N(C2=O)CCC(=O)OCCCC)/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 C20H26N2O6S4 MW 518.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N2O6S4/c1-3-5-11-27-13(23)7-9-21-17(25)15(31-19(21)29)16-18(26)22(20(30)32-16)10-8-14(24)28-12-6-4-2/h3-12H2,1-2H3/b16-15+
InChIKey
SPIRDYZRVYNZQQ-FOCLMDBBSA-N
Synonyms
1164462-82-1
(E)dibutyl33(44dioxo22dithioxo2H2H(55bithiazolylidene)33(4H4H)diyl)dipropanoate
1164462821
3((E)3(2BUTOXYCARBONYLETHYL)44DIOXO22DITHIOXO(55)BITHIAZOLIDINYLIDEN3YL)PROPIONICACIDBUTYLESTER
BUTYL3((5E)5(3(3BUTOXY3OXOPROPYL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOATE
butyl3((5E)5(3(3butoxy3oxopropyl)4oxo2thioxo13thiazolidin5ylidene)4oxo2thioxo13thiazolidin3yl)propanoate
BUTYL3(5(3(2(BUTOXYCARBONYL)ETHYL)4OXO2THIOXO(13THIAZOLIDIN5YLIDENE))4OXO2THIOXO13THIAZOLIDIN3YL)PROPANOATE
CCCCOC(=O)CCN1C(=O)C(=C2C(=O)N(C(=S)S2)CCC(=O)OCCCC)SC1=S
CCCCOC(=O)CCN1C(=S)SC(=C2SC(=S)N(C2=O)CCC(=O)OCCCC)C1=O
InChI=1SC20H26N2O6S4c135112713(23)792117(25)15(3119(21)29)1618(26)22(20(30)3216)10814(24)2812642h312H212H3b1615+
MFCD00326168
ZINC000008691452
ZINC08691452
ZINC8691452

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Available files

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