Vitas-M small molecule compound
8-{[(1,1-dioxidotetrahydrothiophen-3-yl)amino]methyl}-7-hydroxy-4-methyl-2H-chromen-2-one
Catalog ID
STK631211
SMILES O=c1cc(C)c2c(o1)c(CNC1CCS(=O)(=O)C1)c(cc2)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 C15H17NO5S MW 323.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17NO5S/c1-9-6-14(18)21-15-11(9)2-3-13(17)12(15)7-16-10-4-5-22(19,20)8-10/h2-3,6,10,16-17H,4-5,7-8H2,1H3InChIKey
PECNNRHIOPOHFE-UHFFFAOYSA-NSynonyms
8(((11dioxidotetrahydrothiophen3yl)amino)methyl)7hydroxy4methyl2Hchromen2one
8(((11dioxidotetrahydrothiophen3yl)amino)methyl)7hydroxy4methyl2Hchromen2onehydrochloride
8(((11dioxothiolan3yl)amino)methyl)7hydroxy4methylchromen2one
CC1=CC(=O)OC2=C1C=CC(=C2CNC3CCS(=O)(=O)C3)O
InChI=1SC15H17NO5Sc19614(18)211511(9)2313(17)12(15)716104522(1920)810h236101617H4578H21H3
MFCD09845470
O=c1cc(C)c2c(o1)c(CNC1CCS(=O)(=O)C1)c(cc2)OCl
ZINC000009530417
ZINC000009530418
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