Vitas-M small molecule compound

4-(1-benzofuran-2-ylcarbonyl)-3-hydroxy-5-[3-methoxy-4-(pentyloxy)phenyl]-1-(6-methyl-1,3-benzothiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one

Catalog ID
STK799891
SMILES CCCCCOc1ccc(cc1OC)C1N(c2nc3c(s2)cc(cc3)C)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 C33H30N2O6S MW 582.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H30N2O6S/c1-4-5-8-15-40-24-14-12-21(18-25(24)39-3)29-28(30(36)26-17-20-9-6-7-10-23(20)41-26)31(37)32(38)35(29)33-34-22-13-11-19(2)16-27(22)42-33/h6-7,9-14,16-18,29,37H,4-5,8,15H2,1-3H3
InChIKey
JQDKNKVDMXXZNE-UHFFFAOYSA-N
Synonyms

3(1BENZOFURAN2CARBONYL)4HYDROXY2(3METHOXY4PENTOXYPHENYL)1(6METHYL13BENZOTHIAZOL2YL)2HPYRROL5ONE
4(1benzofuran2ylcarbonyl)3hydroxy5(3methoxy4(pentyloxy)phenyl)1(6methyl13benzothiazol2yl)15dihydro2Hpyrrol2one
CCCCCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2C3=NC4=C(S3)C=C(C=C4)C)O)C(=O)C5=CC6=CC=CC=C6O5)OC
InChI=1SC33H30N2O6Sc1458154024141221(1825(24)393)2928(30(36)2617209671023(20)4126)31(37)32(38)35(29)333422131119(2)1627(22)4233h6791416182937H45815H213H3
MFCD04147973
ZINC000008441660
ZINC000008441661

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Available files

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