6-methyl-2-(4-methylpiperazin-4-ium-1-yl)-5-[(4-propan-2-ylphenyl)methyl]-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-2-(4-methylpiperazin-4-ium-1-yl)-5-[(4-propan-2-ylphenyl)methyl]-1H-pyrimidin-4-one Openeye Name: 5-[(4-isopropylphenyl)methyl]-6-methyl-2-(4-methylpiperazin-4-ium-1-yl)-1H-pyrimidin-4-one CAS Name: 6-methyl-2-(4-methyl-1-piperazin-4-iumyl)-5-[(4-propan-2-ylphenyl)methyl]-1H-pyrimidin-4-one IUPAC Name: 6-methyl-2-(4-methylpiperazin-4-ium-1-yl)-5-[(4-propan-2-ylphenyl)methyl]-1H-pyrimidin-4-one Traditional Name: 5-(4-isopropylbenzyl)-6-methyl-2-(4-methylpiperazin-4-ium-1-yl)-1H-pyrimidin-4-one Formula: C20H29N4O+ MolecularWeight: 341.47046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)N2CC[NH+](CC2)C)CC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1=C(C(=O)N=C(N1)N2CC[NH+](CC2)C)CC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C20H28N4O/c1-14(2)17-7-5-16(6-8-17)13-18-15(3)21-20(22-19(18)25)24-11-9-23(4)10-12-24/h5-8,14H,9-13H2,1-4H3,(H,21,22,25)/p+1