Vitas-M small molecule compound

4-(1-benzofuran-2-ylcarbonyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-hydroxy-5-[4-(prop-2-en-1-yloxy)phenyl]-1,5-dihydro-2H-pyrrol-2-one

Catalog ID
STK705727
SMILES C=CCOc1ccc(cc1)C1N(c2nc3c(s2)cc(cc3)OCC)C(=O)C(=C1C(=O)c1cc2c(o1)cccc2)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 C31H24N2O6S MW 552.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H24N2O6S/c1-3-15-38-20-11-9-18(10-12-20)27-26(28(34)24-16-19-7-5-6-8-23(19)39-24)29(35)30(36)33(27)31-32-22-14-13-21(37-4-2)17-25(22)40-31/h3,5-14,16-17,27,35H,1,4,15H2,2H3
InChIKey
LJKQUKLBNLEFDN-UHFFFAOYSA-N
Synonyms

3(1BENZOFURAN2CARBONYL)1(6ETHOXY13BENZOTHIAZOL2YL)4HYDROXY2(4PROP2ENOXYPHENYL)2HPYRROL5ONE
4(1benzofuran2ylcarbonyl)1(6ethoxy13benzothiazol2yl)3hydroxy5(4(prop2en1yloxy)phenyl)15dihydro2Hpyrrol2one
5(4(ALLYLOXY)PHENYL)4(1BENZOFURAN2YLCARBONYL)1(6ETHOXY13BENZOTHIAZOL2YL)3HYDROXY15DIHYDRO2HPYRROL2ONE
CCOC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C3=O)O)C(=O)C4=CC5=CC=CC=C5O4)C6=CC=C(C=C6)OCC=C
InChI=1SC31H24N2O6Sc1315382011918(101220)2726(28(34)241619756823(19)3924)29(35)30(36)33(27)313222141321(3742)1725(22)4031h351416172735H1415H22H3
MFCD04088599
ZINC000008441730
ZINC000008441732

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Available files

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