4-(3,4-dimethoxyphenyl)-6-(4-methylphenyl)-2-(4-methylpiperazin-4-ium-1-yl)pyrimidine

Systemtic Name: 4-(3,4-dimethoxyphenyl)-6-(4-methylphenyl)-2-(4-methylpiperazin-4-ium-1-yl)pyrimidine Openeye Name: 4-(3,4-dimethoxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)-6-(p-tolyl)pyrimidine CAS Name: 4-(3,4-dimethoxyphenyl)-6-(4-methylphenyl)-2-(4-methyl-1-piperazin-4-iumyl)pyrimidine IUPAC Name: 4-(3,4-dimethoxyphenyl)-6-(4-methylphenyl)-2-(4-methylpiperazin-4-ium-1-yl)pyrimidine Traditional Name: 4-(3,4-dimethoxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)-6-(p-tolyl)pyrimidine Formula: C24H29N4O2+ MolecularWeight: 405.51266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NC(=N2)N3CC[NH+](CC3)C)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NC(=N2)N3CC[NH+](CC3)C)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C24H28N4O2/c1-17-5-7-18(8-6-17)20-16-21(19-9-10-22(29-3)23(15-19)30-4)26-24(25-20)28-13-11-27(2)12-14-28/h5-10,15-16H,11-14H2,1-4H3/p+1