4-methylbenzenesulfonate; N'-(1-methylpyridin-5-yl)-N-[4-[(1-methylpyridin-5-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide
Molecular Formula:
C41H39N5O9S2
InChI: InChI=1/C27H23N5O3.2C7H8O3S/c1-31-15-3-5-23(17-31)29-26(34)20-9-7-19(8-10-20)25(33)28-22-13-11-21(12-14-22)27(35)30-24-6-4-16-32(2)18-24;2*1-6-2-4-7(5-3-6)11(8,9)10/h3-18H,1-2H3,(H-2,28,29,30,33,34,35);2*2-5H,1H3,(H,8,9,10)/fC27H25N5O3.2C7H7O3S/h28-30H;;/q+2;2*-1
InChIKey: InChIKey=GNTQHIUCHHWOML-AWFODGNHCL
SMILES: CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=O)NC4=C[N+](=CC=C4)C
Names:
4-methylbenzenesulfonate; N'-(1-methylpyridin-5-yl)-N-[4-[(1-methylpyridin-5-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide
Registries:
PubChem CID 146474
PubChem ID 10249249
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