Vitas-M small molecule compound
3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl N-[(4-methylphenyl)sulfonyl]-beta-alaninate
Catalog ID
STL565539
SMILES O=C(Oc1cc(C)cc2c1c(C)c(c(=O)o2)Cc1ccccc1)CCNS(=O)(=O)c1ccc(cc1)C
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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 C28H27NO6S MW 505.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27NO6S/c1-18-9-11-22(12-10-18)36(32,33)29-14-13-26(30)34-24-15-19(2)16-25-27(24)20(3)23(28(31)35-25)17-21-7-5-4-6-8-21/h4-12,15-16,29H,13-14,17H2,1-3H3InChIKey
URUFOKOJLHMXHQ-UHFFFAOYSA-NSynonyms
858756-57-7(3benzyl47dimethyl2oxochromen5yl)3((4methylphenyl)sulfonylamino)propanoate
1752371
3BENZYL47DIMETHYL2OXO2HCHROMEN5YL3(4METHYLPHENYLSULFONAMIDO)PROPANOATE
3benzyl47dimethyl2oxo2Hchromen5ylN((4methylphenyl)sulfonyl)betaalaninate
858756577
InChI=1SC28H27NO6Sc11891122(121018)36(3233)29141326(30)34241519(2)162527(24)20(3)23(28(31)3525)17217546821h412151629H131417H213H3
MFCD03854003
ZINC000002095971
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