Vitas-M small molecule compound

[(5E)-4-oxo-5-(3-phenoxybenzylidene)-2-thioxo-1,3-thiazolidin-3-yl]acetic acid

Catalog ID
STL258936
SMILES OC(=O)CN1C(=S)S/C(=C/c2cccc(c2)Oc2ccccc2)/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 C18H13NO4S2 MW 371.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13NO4S2/c20-16(21)11-19-17(22)15(25-18(19)24)10-12-5-4-8-14(9-12)23-13-6-2-1-3-7-13/h1-10H,11H2,(H,20,21)/b15-10+
InChIKey
NJNBOILPWXEYGR-XNTDXEJSSA-N
Synonyms
1103516-15-9
((5E)4oxo5(3phenoxybenzylidene)2thioxo13thiazolidin3yl)aceticacid
(4OXO5(3PHENOXYBENZYLIDENE)2THIOXO13THIAZOLIDIN3YL)ACETICACID
(4OXO5(3PHENOXYBENZYLIDENE)2THIOXOTHIAZOLIDIN3YL)ACETICACID
1103516159
2((5E)4OXO5((3PHENOXYPHENYL)METHYLENE)2THIOXOTHIAZOLIDIN3YL)ACETICACID
2((5E)4oxo5((3phenoxyphenyl)methylidene)2sulfanylidene13thiazolidin3yl)aceticacid
C1=CC=C(C=C1)OC2=CC=CC(=C2)C=C3C(=O)N(C(=S)S3)CC(=O)O
InChI=1SC18H13NO4S2c2016(21)111917(22)15(2518(19)24)101254814(912)23136213713h110H11H2(H2021)b1510+
MFCD00650463
OC(=O)CN1C(=S)SC(=Cc2cccc(c2)Oc2ccccc2)C1=O
ZINC000000966883
ZINC966883

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Available files

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