4-methylbenzenesulfonate; N-(1-propylquinolin-6-yl)-N'-[4-[(1-propylquinolin-6-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide

Molecular Formula: C53H51N5O9S2


InChI: InChI=1/C39H35N5O3.2C7H8O3S/c1-3-21-43-23-5-7-30-25-33(17-19-35(30)43)41-38(46)28-11-9-27(10-12-28)37(45)40-32-15-13-29(14-16-32)39(47)42-34-18-20-36-31(26-34)8-6-24-44(36)22-4-2;2*1-6-2-4-7(5-3-6)11(8,9)10/h5-20,23-26H,3-4,21-22H2,1-2H3,(H-2,40,41,42,45,46,47);2*2-5H,1H3,(H,8,9,10)/fC39H37N5O3.2C7H7O3S/h40-42H;;/q+2;2*-1

InChIKey: InChIKey=XWVBNNWJSQSYOW-JJTYQBTFCL
SMILES: CCC[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=CC6=C(C=C5)[N+](=CC=C6)CCC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]

Names:
    4-methylbenzenesulfonate; N-(1-propylquinolin-6-yl)-N'-[4-[(1-propylquinolin-6-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide

Registries:
    PubChem CID 205949
    PubChem ID 10267036