Vitas-M small molecule compound
4-butyl 2-tert-butyl 3-methyl-5-[(3-oxo-1,3-dihydro-2-benzofuran-1-yl)amino]thiophene-2,4-dicarboxylate
Catalog ID
STK898068
SMILES CCCCOC(=O)c1c(sc(c1C)C(=O)OC(C)(C)C)NC1OC(=O)c2c1cccc2
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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 C23H27NO6S MW 445.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27NO6S/c1-6-7-12-28-21(26)16-13(2)17(22(27)30-23(3,4)5)31-19(16)24-18-14-10-8-9-11-15(14)20(25)29-18/h8-11,18,24H,6-7,12H2,1-5H3InChIKey
SITVYJRNYNQYDU-UHFFFAOYSA-NSynonyms
4butyl2tertbutyl3methyl5((3oxo13dihydro2benzofuran1yl)amino)thiophene24dicarboxylate
4Obutyl2Otertbutyl3methyl5((3oxo1H2benzofuran1yl)amino)thiophene24dicarboxylate
CCCCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)(C)C)NC2C3=CC=CC=C3C(=O)O2
InChI=1SC23H27NO6Sc167122821(26)1613(2)17(22(27)3023(34)5)3119(16)24181410891115(14)20(25)2918h8111824H6712H215H3
MFCD18172820
ZINC000044827160
ZINC000044827163
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