Vitas-M small molecule compound

methyl 2-[2-(4-ethoxyphenyl)-4-hydroxy-5-oxo-3-(thiophen-2-ylcarbonyl)-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate

Catalog ID
STK982763
SMILES CCOc1ccc(cc1)C1N(c2nc(c(s2)C(=O)OC)C)C(=O)C(=C1C(=O)c1cccs1)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 C23H20N2O6S2 MW 484.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N2O6S2/c1-4-31-14-9-7-13(8-10-14)17-16(18(26)15-6-5-11-32-15)19(27)21(28)25(17)23-24-12(2)20(33-23)22(29)30-3/h5-11,17,27H,4H2,1-3H3
InChIKey
ZHIGLUXAWSGQPE-UHFFFAOYSA-N
Synonyms
385393-26-0
385393260
CCOC1=CC=C(C=C1)C2C(=C(C(=O)N2C3=NC(=C(S3)C(=O)OC)C)O)C(=O)C4=CC=CS4
InChI=1SC23H20N2O6S2c1431149713(81014)1716(18(26)1565113215)19(27)21(28)25(17)232412(2)20(3323)22(29)303h5111727H4H213H3
methyl2(2(4ethoxyphenyl)4hydroxy5oxo3(thiophen2ylcarbonyl)25dihydro1Hpyrrol1yl)4methyl13thiazole5carboxylate
methyl2(2(4ethoxyphenyl)4hydroxy5oxo3(thiophene2carbonyl)25dihydro1Hpyrrol1yl)4methylthiazole5carboxylate
METHYL2(2(4ETHOXYPHENYL)4HYDROXY5OXO3(THIOPHENE2CARBONYL)2HPYRROL1YL)4METHYL13THIAZOLE5CARBOXYLATE
METHYL2(5(4ETHOXYPHENYL)3HYDROXY2OXO4(2THIENYLCARBONYL)(3PYRROLINYL))4METHYL13THIAZOLE5CARBOXYLATE
MFCD03285822
ZINC000008779287
ZINC000008779288
ZINC08779288

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.