Vitas-M small molecule compound
3-({4-[(5Z)-5-(3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)benzoic acid
Catalog ID
STL036002
SMILES COc1cccc(c1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)Nc1cccc(c1)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 C22H20N2O5S2 MW 456.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O5S2/c1-29-17-8-2-5-14(11-17)12-18-20(26)24(22(30)31-18)10-4-9-19(25)23-16-7-3-6-15(13-16)21(27)28/h2-3,5-8,11-13H,4,9-10H2,1H3,(H,23,25)(H,27,28)/b18-12-InChIKey
NVGISFXRXWKZMO-PDGQHHTCSA-NSynonyms
476666-46-33((4((5Z)5(3methoxybenzylidene)4oxo2thioxo13thiazolidin3yl)butanoyl)amino)benzoicacid
3(4((5Z)5((3METHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOYLAMINO)BENZOICACID
3(4(5((3METHOXYPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)BUTANOYLAMINO)BENZOICACID
476666463
COC1=CC=CC(=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)NC3=CC=CC(=C3)C(=O)O
COc1cccc(c1)C=C1SC(=S)N(C1=O)CCCC(=O)Nc1cccc(c1)C(=O)O
InChI=1SC22H20N2O5S2c1291782514(1117)121820(26)24(22(30)3118)104919(25)231673615(1316)21(27)28h23581113H4910H21H3(H2325)(H2728)b1812
MFCD06742908
ZINC000008819185
ZINC8819185
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