Vitas-M small molecule compound
N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-ethoxybenzyl)-6,8-dimethyl-4-oxo-4H-chromene-2-carboxamide
Catalog ID
STK848176
SMILES CCOc1ccc(cc1)CN(C(=O)c1cc(=O)c2c(o1)c(C)cc(c2)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 C25H27NO6S MW 469.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO6S/c1-4-31-20-7-5-18(6-8-20)14-26(19-9-10-33(29,30)15-19)25(28)23-13-22(27)21-12-16(2)11-17(3)24(21)32-23/h5-8,11-13,19H,4,9-10,14-15H2,1-3H3InChIKey
XCJUECOPSBLBDI-UHFFFAOYSA-NSynonyms
874128-27-5874128275
CCOC1=CC=C(C=C1)CN(C2CCS(=O)(=O)C2)C(=O)C3=CC(=O)C4=CC(=CC(=C4O3)C)C
InChI=1SC25H27NO6Sc1431207518(6820)1426(1991033(2930)1519)25(28)231322(27)211216(2)1117(3)24(21)3223h58111319H49101415H213H3
MFCD06604557
N(11dioxidotetrahydrothiophen3yl)N(4ethoxybenzyl)68dimethyl4oxo4Hchromene2carboxamide
N(11DIOXOTHIOLAN3YL)N((4ETHOXYPHENYL)METHYL)68DIMETHYL4OXOCHROMENE2CARBOXAMIDE
ZINC000008612331
ZINC000008612332
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