Vitas-M small molecule compound
3-hydroxy-1-[2-(pyrrolidin-1-yl)ethyl]-4-(thiophen-2-ylcarbonyl)-5-(3,4,5-trimethoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STL434544
SMILES COc1cc(cc(c1OC)OC)C1N(CCN2CCCC2)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 C24H28N2O6S MW 472.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O6S/c1-30-16-13-15(14-17(31-2)23(16)32-3)20-19(21(27)18-7-6-12-33-18)22(28)24(29)26(20)11-10-25-8-4-5-9-25/h6-7,12-14,20,28H,4-5,8-11H2,1-3H3InChIKey
IEPNMLIYRQENHE-UHFFFAOYSA-NSynonyms
3hydroxy1(2(pyrrolidin1yl)ethyl)4(thiophen2ylcarbonyl)5(345trimethoxyphenyl)15dihydro2Hpyrrol2one
4hydroxy1(2pyrrolidin1ylethyl)3(thiophene2carbonyl)2(345trimethoxyphenyl)2Hpyrrol5one
COC1=CC(=CC(=C1OC)OC)C2C(=C(C(=O)N2CCN3CCCC3)O)C(=O)C4=CC=CS4
InChI=1SC24H28N2O6Sc130161315(1417(312)23(16)323)2019(21(27)1876123318)22(28)24(29)26(20)111025845925h6712142028H45811H213H3
MFCD30711196
ZINC000041537673
ZINC000041537677
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