Vitas-M small molecule compound
methyl 2-{2-[4-(hexyloxy)-3-methoxyphenyl]-4-hydroxy-3-[(4-methylphenyl)sulfonyl]-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK516298
SMILES CCCCCCOc1ccc(cc1OC)C1N(c2nc(c(s2)C(=O)OC)C)C(=O)C(=C1S(=O)(=O)c1ccc(cc1)C)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 C30H34N2O8S2 MW 614.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N2O8S2/c1-6-7-8-9-16-40-22-15-12-20(17-23(22)38-4)24-27(42(36,37)21-13-10-18(2)11-14-21)25(33)28(34)32(24)30-31-19(3)26(41-30)29(35)39-5/h10-15,17,24,33H,6-9,16H2,1-5H3InChIKey
OIDUJYPEBNZMEX-UHFFFAOYSA-NSynonyms
CCCCCCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2C3=NC(=C(S3)C(=O)OC)C)O)S(=O)(=O)C4=CC=C(C=C4)C)OC
InChI=1SC30H34N2O8S2c16789164022151220(1723(22)384)2427(42(3637)21131018(2)111421)25(33)28(34)32(24)303119(3)26(4130)29(35)395h1015172433H6916H215H3
methyl2(2(4(hexyloxy)3methoxyphenyl)4hydroxy3((4methylphenyl)sulfonyl)5oxo25dihydro1Hpyrrol1yl)4methyl13thiazole5carboxylate
methyl2(2(4hexoxy3methoxyphenyl)4hydroxy3(4methylphenyl)sulfonyl5oxo2Hpyrrol1yl)4methyl13thiazole5carboxylate
MFCD06645603
ZINC000098047941
ZINC000098047942
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