N-(1-butylquinolin-6-yl)-4-[(1-butylquinolin-6-yl)carbamoylmethoxy]benzamide; 4-methylbenzenesulfonate

Molecular Formula: C49H52N4O9S2


InChI: InChI=1/C35H36N4O3.2C7H8O3S/c1-3-5-19-38-21-7-9-27-23-29(13-17-32(27)38)36-34(40)25-42-31-15-11-26(12-16-31)35(41)37-30-14-18-33-28(24-30)10-8-22-39(33)20-6-4-2;2*1-6-2-4-7(5-3-6)11(8,9)10/h7-18,21-24H,3-6,19-20,25H2,1-2H3;2*2-5H,1H3,(H,8,9,10)/fC35H38N4O3.2C7H7O3S/h36-37H;;/q+2;2*-1

InChIKey: InChIKey=JTWHAKHOQZWYSX-IIAKQXCCCK
SMILES: CCCC[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)COC3=CC=C(C=C3)C(=O)NC4=CC5=C(C=C4)[N+](=CC=C5)CCCC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]

Names:
    N-(1-butylquinolin-6-yl)-4-[(1-butylquinolin-6-yl)carbamoylmethoxy]benzamide; 4-methylbenzenesulfonate

Registries:
    PubChem CID 205746
    PubChem ID 10266915