2-[[[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]amino]methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[[[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]amino]methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[[4-(4-ethylpiperazin-4-ium-1-yl)anilino]methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[4-(4-ethyl-1-piperazin-4-iumyl)anilino]methyl]-7-methyl-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[[4-(4-ethylpiperazin-4-ium-1-yl)anilino]methyl]-7-methylpyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[4-(4-ethylpiperazin-4-ium-1-yl)anilino]methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Formula: C22H28N5O+ MolecularWeight: 378.49062

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NCC3=CC(=O)N4C=C(C=CC4=N3)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NCC3=CC(=O)N4C=C(C=CC4=N3)C

InChI

InChI=1S/C22H27N5O/c1-3-25-10-12-26(13-11-25)20-7-5-18(6-8-20)23-15-19-14-22(28)27-16-17(2)4-9-21(27)24-19/h4-9,14,16,23H,3,10-13,15H2,1-2H3/p+1