Vitas-M small molecule compound
1-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-(1,1-dioxidotetrahydrothiophen-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Catalog ID
STK517007
SMILES COc1cc(cc(c1O)Br)C1N(C2CCS(=O)(=O)C2)C(=O)c2c1c(=O)c1c(o2)cccc1
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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 C22H18BrNO7S MW 520.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrNO7S/c1-30-16-9-11(8-14(23)20(16)26)18-17-19(25)13-4-2-3-5-15(13)31-21(17)22(27)24(18)12-6-7-32(28,29)10-12/h2-5,8-9,12,18,26H,6-7,10H2,1H3InChIKey
HPYNXYXXDUMFBM-UHFFFAOYSA-NSynonyms
1(3bromo4hydroxy5methoxyphenyl)2(11dioxidotetrahydrothiophen3yl)12dihydrochromeno(23c)pyrrole39dione
1(3bromo4hydroxy5methoxyphenyl)2(11dioxothiolan3yl)1Hchromeno(23c)pyrrole39dione
COC1=C(C(=CC(=C1)C2C3=C(C(=O)N2C4CCS(=O)(=O)C4)OC5=CC=CC=C5C3=O)Br)O
InChI=1SC22H18BrNO7Sc13016911(814(23)20(16)26)181719(25)13423515(13)3121(17)22(27)24(18)126732(2829)1012h2589121826H6710H21H3
MFCD07455710
ZINC000098046988
ZINC000098046991
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