4-methylbenzenesulfonate; 2-methyl-N,N'-bis[4-[(1-methylpyridin-5-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide

Molecular Formula: C49H46N6O10S2


InChI: InChI=1/C35H30N6O4.2C7H8O3S/c1-23-20-26(34(44)36-27-13-8-24(9-14-27)32(42)38-29-6-4-18-40(2)21-29)12-17-31(23)35(45)37-28-15-10-25(11-16-28)33(43)39-30-7-5-19-41(3)22-30;2*1-6-2-4-7(5-3-6)11(8,9)10/h4-22H,1-3H3,(H2-2,36,37,38,39,42,43,44,45);2*2-5H,1H3,(H,8,9,10)/fC35H32N6O4.2C7H7O3S/h36-39H;;/q+2;2*-1

InChIKey: InChIKey=GKFQTJNPIBCODM-FGBFBWEFCZ
SMILES: CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)NC3=C[N+](=CC=C3)C)C(=O)NC4=CC=C(C=C4)C(=O)NC5=C[N+](=CC=C5)C

Names:
    4-methylbenzenesulfonate; 2-methyl-N,N'-bis[4-[(1-methylpyridin-5-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide

Registries:
    PubChem CID 204645
    PubChem ID 10266368