N4-(3-imidazolidin-1-ylpropyl)-N2-[3-(3-methoxyphenyl)phenyl]pyrimidine-2,4-diamine

Systemtic Name: N4-(3-imidazolidin-1-ylpropyl)-N2-[3-(3-methoxyphenyl)phenyl]pyrimidine-2,4-diamine Openeye Name: N4-(3-imidazolidin-1-ylpropyl)-N2-[3-(3-methoxyphenyl)phenyl]pyrimidine-2,4-diamine CAS Name: N4-[3-(1-imidazolidinyl)propyl]-N2-[3-(3-methoxyphenyl)phenyl]pyrimidine-2,4-diamine IUPAC Name: 4-N-(3-imidazolidin-1-ylpropyl)-2-N-[3-(3-methoxyphenyl)phenyl]pyrimidine-2,4-diamine Traditional Name: 3-imidazolidin-1-ylpropyl-[2-[3-(3-methoxyphenyl)anilino]pyrimidin-4-yl]amine Formula: C23H28N6O MolecularWeight: 404.50802

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CC(=CC=C2)NC3=NC=CC(=N3)NCCCN4CCNC4

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC(=CC=C2)NC3=NC=CC(=N3)NCCCN4CCNC4

InChI

InChI=1S/C23H28N6O/c1-30-21-8-3-6-19(16-21)18-5-2-7-20(15-18)27-23-26-11-9-22(28-23)25-10-4-13-29-14-12-24-17-29/h2-3,5-9,11,15-16,24H,4,10,12-14,17H2,1H3,(H2,25,26,27,28)