4-methylbenzenesulfonate; 2-methyl-N,N'-bis[4-[(1-propylpyridin-5-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide
Molecular Formula:
C53H54N6O10S2
InChI: InChI=1/C39H38N6O4.2C7H8O3S/c1-4-20-44-22-6-8-33(25-44)42-36(46)28-10-15-31(16-11-28)40-38(48)30-14-19-35(27(3)24-30)39(49)41-32-17-12-29(13-18-32)37(47)43-34-9-7-23-45(26-34)21-5-2;2*1-6-2-4-7(5-3-6)11(8,9)10/h6-19,22-26H,4-5,20-21H2,1-3H3,(H2-2,40,41,42,43,46,47,48,49);2*2-5H,1H3,(H,8,9,10)/fC39H40N6O4.2C7H7O3S/h40-43H;;/q+2;2*-1
InChIKey: InChIKey=NKGQYUUHPUXQAL-RYYIPOHVCS
SMILES: CCC[N+]1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=C[N+](=CC=C5)CCC)C.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]
Names:
4-methylbenzenesulfonate; 2-methyl-N,N'-bis[4-[(1-propylpyridin-5-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide
Registries:
PubChem CID 204655
PubChem ID 10266373
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