Vitas-M small molecule compound
[(5E)-5-{4-[(2-cyanobenzyl)oxy]benzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
Catalog ID
STL428639
SMILES N#Cc1ccccc1COc1ccc(cc1)/C=C\1/SC(=S)N(C1=O)CC(=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 C20H14N2O4S2 MW 410.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N2O4S2/c21-10-14-3-1-2-4-15(14)12-26-16-7-5-13(6-8-16)9-17-19(25)22(11-18(23)24)20(27)28-17/h1-9H,11-12H2,(H,23,24)/b17-9+InChIKey
PAMGWNDNIIIPEC-RQZCQDPDSA-NSynonyms
((5E)5(4((2cyanobenzyl)oxy)benzylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
2((5E)5((4((2cyanophenyl)methoxy)phenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)aceticacid
2(5((4((2CYANOPHENYL)METHOXY)PHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
C1=CC=C(C(=C1)COC2=CC=C(C=C2)C=C3C(=O)N(C(=S)S3)CC(=O)O)C#N
InChI=1SC20H14N2O4S2c211014312415(14)1226167513(6816)91719(25)22(1118(23)24)20(27)2817h19H1112H2(H2324)b179+
MFCD04084411
N#Cc1ccccc1COc1ccc(cc1)C=C1SC(=S)N(C1=O)CC(=O)O
ZINC000006926916
ZINC6926916
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