2,5-dimethyl-N,N'-bis[4-[(1-methylpyridin-5-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide; 4-methylbenzenesulfonate
Molecular Formula:
C50H48N6O10S2
InChI: InChI=1/C36H32N6O4.2C7H8O3S/c1-23-19-32(36(46)38-28-15-11-26(12-16-28)34(44)40-30-8-6-18-42(4)22-30)24(2)20-31(23)35(45)37-27-13-9-25(10-14-27)33(43)39-29-7-5-17-41(3)21-29;2*1-6-2-4-7(5-3-6)11(8,9)10/h5-22H,1-4H3,(H2-2,37,38,39,40,43,44,45,46);2*2-5H,1H3,(H,8,9,10)/fC36H34N6O4.2C7H7O3S/h37-40H;;/q+2;2*-1
InChIKey: InChIKey=XFDVDOXYZIEMPT-UOWPUWBQCQ
SMILES: CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC(=C(C=C1C(=O)NC2=CC=C(C=C2)C(=O)NC3=C[N+](=CC=C3)C)C)C(=O)NC4=CC=C(C=C4)C(=O)NC5=C[N+](=CC=C5)C
Names:
2,5-dimethyl-N,N'-bis[4-[(1-methylpyridin-5-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide; 4-methylbenzenesulfonate
Registries:
PubChem CID 159953
PubChem ID 10253826
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