MLS000069740

PubChem Notes:

3,4-Dichloro-N-methyl-N-(2-(1-pyrrolidinyl)-cyclohexyl)-benzeneacetamide, (trans)-Isomer A non-peptide, kappa-opioid receptor agonist which has also been found to stimulate the release of adrenocorticotropin (CORTICOTROPIN) via the release of hypothalamic arginine vasopressin (ARGIPRESSIN) and CORTICOTROPIN-RELEASING HORMONE. (From J Pharmacol Exp Ther 1997;280(1):416-21)

Molecular Formula: C20H30Cl2N2O4S


InChI: InChI=1/C19H26Cl2N2O.CH4O3S/c1-22(19(24)13-14-8-9-15(20)16(21)12-14)17-6-2-3-7-18(17)23-10-4-5-11-23;1-5(2,3)4/h8-9,12,17-18H,2-7,10-11,13H2,1H3;1H3,(H,2,3,4)/t17-,18-;/m1./s1/f/h;2H

InChIKey: InChIKey=OJPHNZCUXUUVKU-VLADREERDS
SMILES: CN(C1CCCCC1N2CCCC2)C(=O)CC3=CC(=C(C=C3)Cl)Cl.CS(=O)(=O)O

Names:
    MLS000069740
    SMR000058892
    U-50488H
    2-(3,4-dichlorophenyl)-N-methyl-N-[(1R,2R)-2-pyrrolidin-1-ylcyclohexyl]acetamide; methanesulfonic acid

Registries:
    PubChem CID 135349
    PubChem ID 11532953