Vitas-M small molecule compound
N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-[(4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-5-yl)oxy]acetamide
Catalog ID
STL472549
SMILES O=C(NC1CCS(=O)(=O)C1)COc1cc2OC(C)(C)CCc2c2c1c(C)cc(=O)o2
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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 C21H25NO7S MW 435.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO7S/c1-12-8-18(24)28-20-14-4-6-21(2,3)29-15(14)9-16(19(12)20)27-10-17(23)22-13-5-7-30(25,26)11-13/h8-9,13H,4-7,10-11H2,1-3H3,(H,22,23)InChIKey
VMSZULJGGDPUEA-UHFFFAOYSA-NSynonyms
1401529-95-01401529950
CC1=CC(=O)OC2=C3CCC(OC3=CC(=C12)OCC(=O)NC4CCS(=O)(=O)C4)(C)C
InChI=1SC21H25NO7Sc112818(24)2820144621(23)2915(14)916(19(12)20)271017(23)22135730(2526)1113h8913H471011H213H3(H2223)
MFCD27962339
N(11dioxidotetrahydrothiophen3yl)2((488trimethyl2oxo28910tetrahydropyrano(23f)chromen5yl)oxy)acetamide
N(11dioxidotetrahydrothiophen3yl)2((488trimethyl2oxo910dihydro2H8Hpyrano(23f)chromen5yl)oxy)acetamide
N(11dioxothiolan3yl)2((488trimethyl2oxo910dihydropyrano(23h)chromen5yl)oxy)acetamide
ZINC000079190582
ZINC000079190586
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