6-methyl-2-morpholin-4-yl-5-[3-oxidanylidene-3-[4-(phenylmethyl)piperazin-4-ium-1-yl]propyl]-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-2-morpholin-4-yl-5-[3-oxidanylidene-3-[4-(phenylmethyl)piperazin-4-ium-1-yl]propyl]-1H-pyrimidin-4-one Openeye Name: 5-[3-(4-benzylpiperazin-4-ium-1-yl)-3-oxo-propyl]-6-methyl-2-morpholino-1H-pyrimidin-4-one CAS Name: 6-methyl-2-(4-morpholinyl)-5-[3-oxo-3-[4-(phenylmethyl)-1-piperazin-4-iumyl]propyl]-1H-pyrimidin-4-one IUPAC Name: 5-[3-(4-benzylpiperazin-4-ium-1-yl)-3-oxopropyl]-6-methyl-2-morpholin-4-yl-1H-pyrimidin-4-one Traditional Name: 5-[3-(4-benzylpiperazin-4-ium-1-yl)-3-keto-propyl]-6-methyl-2-morpholino-1H-pyrimidin-4-one Formula: C23H32N5O3+ MolecularWeight: 426.53188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)N2CCOCC2)CCC(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)N=C(N1)N2CCOCC2)CCC(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H31N5O3/c1-18-20(22(30)25-23(24-18)28-13-15-31-16-14-28)7-8-21(29)27-11-9-26(10-12-27)17-19-5-3-2-4-6-19/h2-6H,7-17H2,1H3,(H,24,25,30)/p+1