Vitas-M small molecule compound
N-[1-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-1-oxo-3-phenylpropan-2-yl]-4-methoxybenzenesulfonamide
Catalog ID
STL348619
SMILES COc1ccc(cc1)S(=O)(=O)NC(C(=O)N1CCC2(C(C1)CCCC2)O)Cc1ccccc1
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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 C25H32N2O5S MW 472.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N2O5S/c1-32-21-10-12-22(13-11-21)33(30,31)26-23(17-19-7-3-2-4-8-19)24(28)27-16-15-25(29)14-6-5-9-20(25)18-27/h2-4,7-8,10-13,20,23,26,29H,5-6,9,14-18H2,1H3InChIKey
OKWKOOCCWHZTRK-UHFFFAOYSA-NSynonyms
COC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)N3CCC4(CCCCC4C3)O
COc1ccc(cc1)S(=O)(=O)N(C@H)(C(=O)N1CC(C@@)2((C@H)(C1)CCCC2)O)Cc1ccccc1
InChI=1SC25H32N2O5Sc13221101222(131121)33(3031)2623(17197324819)24(28)27161525(29)1465920(25)1827h2478101320232629H5691418H21H3
MFCD28032594
N((2S)1((4AR8AR)4AHYDROXYOCTAHYDROISOQUINOLIN2(1H)YL)1OXO3PHENYLPROPAN2YL)4METHOXYBENZENESULFONAMIDE
N((S)1((4aS8aS)4ahydroxyoctahydroisoquinolin2(1H)yl)1oxo3phenylpropan2yl)4methoxybenzenesulfonamide
N(1(4ahydroxy13456788aoctahydroisoquinolin2yl)1oxo3phenylpropan2yl)4methoxybenzenesulfonamide
N(1(4ahydroxyoctahydroisoquinolin2(1H)yl)1oxo3phenylpropan2yl)4methoxybenzenesulfonamide
ZINC000008606824
ZINC000245311379
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