Vitas-M small molecule compound

2-[(5Z)-5-(4-ethoxy-3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]pentanoic acid

Catalog ID
STL005449
SMILES CCCC(N1C(=S)S/C(=C\c2ccc(c(c2)OC)OCC)/C1=O)C(=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 C18H21NO5S2 MW 395.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21NO5S2/c1-4-6-12(17(21)22)19-16(20)15(26-18(19)25)10-11-7-8-13(24-5-2)14(9-11)23-3/h7-10,12H,4-6H2,1-3H3,(H,21,22)/b15-10-
InChIKey
IARHMPSMLVQMIE-GDNBJRDFSA-N
Synonyms

(Z)2(5(4ethoxy3methoxybenzylidene)4oxo2thioxothiazolidin3yl)pentanoicacid
2((5Z)5((4ETHOXY3METHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PENTANOICACID
2((5Z)5(4ethoxy3methoxybenzylidene)4oxo2thioxo13thiazolidin3yl)pentanoicacid
2(5((4ETHOXY3METHOXYPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)PENTANOICACID
CCCC(C(=O)O)N1C(=O)C(=CC2=CC(=C(C=C2)OCC)OC)SC1=S
CCCC(N1C(=S)SC(=Cc2ccc(c(c2)OC)OCC)C1=O)C(=O)O
InChI=1SC18H21NO5S2c14612(17(21)22)1916(20)15(2618(19)25)10117813(2452)14(911)233h71012H46H213H3(H2122)b1510
MFCD05686275
ZINC000005373707
ZINC000005373712

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Available files

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