Vitas-M small molecule compound
ethyl 2-{(4E)-4-[(2,7-dimethoxynaphthalen-1-yl)methylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK076250
SMILES CCOC(=O)c1sc(nc1C)N1N=C(/C(=C\c2c(OC)ccc3c2cc(OC)cc3)/C1=O)C
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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 C24H23N3O5S MW 465.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O5S/c1-6-32-23(29)21-14(3)25-24(33-21)27-22(28)17(13(2)26-27)12-19-18-11-16(30-4)9-7-15(18)8-10-20(19)31-5/h7-12H,6H2,1-5H3/b17-12+InChIKey
IUZUXIVDTALHIR-SFQUDFHCSA-NSynonyms
CCOC(=O)C1=C(N=C(S1)N2C(=O)C(=CC3=C(C=CC4=C3C=C(C=C4)OC)OC)C(=N2)C)C
CCOC(=O)c1sc(nc1C)N1N=C(C(=Cc2c(OC)ccc3c2cc(OC)cc3)C1=O)C
ETHYL2((4E)4((27DIMETHOXYNAPHTHALEN1YL)METHYLIDENE)3METHYL5OXO45DIHYDRO1HPYRAZOL1YL)4METHYL13THIAZOLE5CARBOXYLATE
ETHYL2((4E)4((27DIMETHOXYNAPHTHALEN1YL)METHYLIDENE)3METHYL5OXOPYRAZOL1YL)4METHYL13THIAZOLE5CARBOXYLATE
ETHYL2(4((27DIMETHOXYNAPHTHYL)METHYLENE)3METHYL5OXO(12DIAZOLINYL))4METHYL13THIAZOLE5CARBOXYLATE
InChI=1SC24H23N3O5Sc163223(29)2114(3)2524(3321)2722(28)17(13(2)2627)1219181116(304)9715(18)81020(19)315h712H6H215H3b1712+
MFCD03271145
STK076250
ZINC000008815827
ZINC08815827
ZINC8815827
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.