Vitas-M small molecule compound
N-(1,1-dioxidotetrahydrothiophen-3-yl)-6,8-dimethyl-4-oxo-N-(4-propoxybenzyl)-4H-chromene-3-carboxamide
Catalog ID
STK518474
SMILES CCCOc1ccc(cc1)CN(C(=O)c1coc2c(c1=O)cc(cc2C)C)C1CCS(=O)(=O)C1
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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 C26H29NO6S MW 483.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29NO6S/c1-4-10-32-21-7-5-19(6-8-21)14-27(20-9-11-34(30,31)16-20)26(29)23-15-33-25-18(3)12-17(2)13-22(25)24(23)28/h5-8,12-13,15,20H,4,9-11,14,16H2,1-3H3InChIKey
WSTBMJJUNKRPAS-UHFFFAOYSA-NSynonyms
CCCOC1=CC=C(C=C1)CN(C2CCS(=O)(=O)C2)C(=O)C3=COC4=C(C=C(C=C4C3=O)C)C
InChI=1SC26H29NO6Sc141032217519(6821)1427(2091134(3031)1620)26(29)2315332518(3)1217(2)1322(25)24(23)28h5812131520H49111416H213H3
MFCD12918143
N(11dioxidotetrahydrothiophen3yl)68dimethyl4oxoN(4propoxybenzyl)4Hchromene3carboxamide
N(11dioxothiolan3yl)68dimethyl4oxoN((4propoxyphenyl)methyl)chromene3carboxamide
ZINC000027748899
ZINC000027748906
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