Vitas-M small molecule compound
methyl 2-[3-hydroxy-5-(4-methylphenyl)-2-oxo-4-(thiophen-2-ylcarbonyl)-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK702978
SMILES COC(=O)c1sc(nc1C)N1C(c2ccc(cc2)C)C(=C(C1=O)O)C(=O)c1cccs1
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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 C22H18N2O5S2 MW 454.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N2O5S2/c1-11-6-8-13(9-7-11)16-15(17(25)14-5-4-10-30-14)18(26)20(27)24(16)22-23-12(2)19(31-22)21(28)29-3/h4-10,16,26H,1-3H3InChIKey
MQQCXMSOZSGXFV-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C2C(=C(C(=O)N2C3=NC(=C(S3)C(=O)OC)C)O)C(=O)C4=CC=CS4
InChI=1SC22H18N2O5S2c1116813(9711)1615(17(25)1454103014)18(26)20(27)24(16)222312(2)19(3122)21(28)293h4101626H13H3
methyl2(3hydroxy2oxo4(thiophene2carbonyl)5(ptolyl)25dihydro1Hpyrrol1yl)4methylthiazole5carboxylate
methyl2(3hydroxy5(4methylphenyl)2oxo4(thiophen2ylcarbonyl)25dihydro1Hpyrrol1yl)4methyl13thiazole5carboxylate
METHYL2(4HYDROXY2(4METHYLPHENYL)5OXO3(THIOPHENE2CARBONYL)2HPYRROL1YL)4METHYL13THIAZOLE5CARBOXYLATE
MFCD02995373
ZINC000008915028
ZINC000008915029
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