Vitas-M small molecule compound

4-(1-benzofuran-2-ylcarbonyl)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(3-ethoxy-4-hydroxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one

Catalog ID
STK817339
SMILES CCOc1cc(ccc1O)C1N(c2sc3c(n2)c(C)cc(c3)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 C30H24N2O6S MW 540.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24N2O6S/c1-4-37-21-14-18(9-10-19(21)33)26-24(27(34)22-13-17-7-5-6-8-20(17)38-22)28(35)29(36)32(26)30-31-25-16(3)11-15(2)12-23(25)39-30/h5-14,26,33,35H,4H2,1-3H3
InChIKey
YQSRTHFTUCXNRW-UHFFFAOYSA-N
Synonyms

3(1BENZOFURAN2CARBONYL)1(46DIMETHYL13BENZOTHIAZOL2YL)2(3ETHOXY4HYDROXYPHENYL)4HYDROXY2HPYRROL5ONE
4(1benzofuran2ylcarbonyl)1(46dimethyl13benzothiazol2yl)5(3ethoxy4hydroxyphenyl)3hydroxy15dihydro2Hpyrrol2one
4(BENZO(D)FURAN2YLCARBONYL)1(46DIMETHYLBENZOTHIAZOL2YL)5(3ETHOXY4HYDROXYPHENYL)3HYDROXY3PYRROLIN2ONE
CCOC1=C(C=CC(=C1)C2C(=C(C(=O)N2C3=NC4=C(C=C(C=C4S3)C)C)O)C(=O)C5=CC6=CC=CC=C6O5)O
InChI=1SC30H24N2O6Sc1437211418(91019(21)33)2624(27(34)221317756820(17)3822)28(35)29(36)32(26)30312516(3)1115(2)1223(25)3930h514263335H4H213H3
MFCD04088591
ZINC000000703130
ZINC000000703131

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Available files

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