N-butyl-N-methyl-3-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine-2-carboxamide

Systemtic Name: N-butyl-N-methyl-3-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine-2-carboxamide Openeye Name: N-butyl-N-methyl-3-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine-2-carboxamide CAS Name: N-butyl-N-methyl-3-[[4-(2-pyridin-1-iumyl)-1-piperazinyl]methyl]-2-imidazo[1,2-a]pyridinecarboxamide IUPAC Name: N-butyl-N-methyl-3-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine-2-carboxamide Traditional Name: N-butyl-N-methyl-3-[(4-pyridin-1-ium-2-ylpiperazino)methyl]imidazo[1,2-a]pyridine-2-carboxamide Formula: C23H31N6O+ MolecularWeight: 407.53184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C1=C(N2C=CC=CC2=N1)CN3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

CCCCN(C)C(=O)C1=C(N2C=CC=CC2=N1)CN3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C23H30N6O/c1-3-4-12-26(2)23(30)22-19(29-13-8-6-10-21(29)25-22)18-27-14-16-28(17-15-27)20-9-5-7-11-24-20/h5-11,13H,3-4,12,14-18H2,1-2H3/p+1