Vitas-M small molecule compound
4-{[(1-{(Z)-[2,4-dioxo-3-(prop-2-yn-1-yl)-1,3-thiazolidin-5-ylidene]methyl}naphthalen-2-yl)oxy]methyl}benzoic acid
Catalog ID
STK152547
SMILES C#CCN1C(=O)S/C(=C\c2c(OCc3ccc(cc3)C(=O)O)ccc3c2cccc3)/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 C25H17NO5S MW 443.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17NO5S/c1-2-13-26-23(27)22(32-25(26)30)14-20-19-6-4-3-5-17(19)11-12-21(20)31-15-16-7-9-18(10-8-16)24(28)29/h1,3-12,14H,13,15H2,(H,28,29)/b22-14-InChIKey
UFAHVXATRFMFLS-HMAPJEAMSA-NSynonyms
4(((1((Z)(24DIOXO3(PROP2YN1YL)13THIAZOLIDIN5YLIDENE)METHYL)NAPHTHALEN2YL)OXY)METHYL)BENZOICACID
4((1((Z)(24DIOXO3PROP2YNYL13THIAZOLIDIN5YLIDENE)METHYL)NAPHTHALEN2YL)OXYMETHYL)BENZOICACID
C#CCN1C(=O)C(=CC2=C(C=CC3=CC=CC=C32)OCC4=CC=C(C=C4)C(=O)O)SC1=O
C#CCN1C(=O)SC(=Cc2c(OCc3ccc(cc3)C(=O)O)ccc3c2cccc3)C1=O
InChI=1SC25H17NO5Sc12132623(27)22(3225(26)30)142019643517(19)111221(20)3115167918(10816)24(28)29h131214H1315H2(H2829)b2214
MFCD06662898
ZINC000001164839
ZINC1164839
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