Vitas-M small molecule compound
methyl 2-{2-(4-ethoxy-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
STK516296
SMILES CCOc1ccc(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 C26H26N2O8S2 MW 558.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O8S2/c1-6-36-18-12-9-16(13-19(18)34-4)20-23(38(32,33)17-10-7-14(2)8-11-17)21(29)24(30)28(20)26-27-15(3)22(37-26)25(31)35-5/h7-13,20,29H,6H2,1-5H3InChIKey
VOFSPRAEGNRHIN-UHFFFAOYSA-NSynonyms
CCOC1=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=1SC26H26N2O8S2c16361812916(1319(18)344)2023(38(3233)1710714(2)81117)21(29)24(30)28(20)262715(3)22(3726)25(31)355h7132029H6H215H3
methyl2(2(4ethoxy3methoxyphenyl)4hydroxy3((4methylphenyl)sulfonyl)5oxo25dihydro1Hpyrrol1yl)4methyl13thiazole5carboxylate
methyl2(2(4ethoxy3methoxyphenyl)4hydroxy3(4methylphenyl)sulfonyl5oxo2Hpyrrol1yl)4methyl13thiazole5carboxylate
MFCD06645601
ZINC000098047939
ZINC000098047940
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