Vitas-M small molecule compound
ethyl 6-tert-butyl-2-[(3-oxo-1,3-dihydro-2-benzofuran-1-yl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK898071
SMILES CCOC(=O)c1c(sc2c1CCC(C2)C(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 C23H27NO4S MW 413.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27NO4S/c1-5-27-22(26)18-16-11-10-13(23(2,3)4)12-17(16)29-20(18)24-19-14-8-6-7-9-15(14)21(25)28-19/h6-9,13,19,24H,5,10-12H2,1-4H3InChIKey
QEQUPJBPQHPCDQ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCC(C2)C(C)(C)C)NC3C4=CC=CC=C4C(=O)O3
ethyl6tertbutyl2((3oxo13dihydro2benzofuran1yl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl6tertbutyl2((3oxo1H2benzofuran1yl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC23H27NO4Sc152722(26)1816111013(23(23)4)1217(16)2920(18)241914867915(14)21(25)2819h69131924H51012H214H3
MFCD18172823
ZINC000044827185
ZINC000044827194
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