N-[3-[[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]methylcarbamoylamino]methyl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[3-[[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]methylcarbamoylamino]methyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[3-[[[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]methylcarbamoylamino]methyl]phenyl]cyclopropanecarboxamide CAS Name: N-[3-[[[[[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]methylamino]-oxomethyl]amino]methyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]methylcarbamoylamino]methyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[3-[[[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]methylcarbamoylamino]methyl]phenyl]cyclopropanecarboxamide Formula: C23H31N6O2+ MolecularWeight: 423.53124

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=C(C=C2)CNC(=O)NCC3=CC(=CC=C3)NC(=O)C4CC4

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=C(C=C2)CNC(=O)NCC3=CC(=CC=C3)NC(=O)C4CC4

InChI

InChI=1S/C23H30N6O2/c1-28-9-11-29(12-10-28)21-8-5-18(15-24-21)16-26-23(31)25-14-17-3-2-4-20(13-17)27-22(30)19-6-7-19/h2-5,8,13,15,19H,6-7,9-12,14,16H2,1H3,(H,27,30)(H2,25,26,31)/p+1