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

Systemtic Name: N2-[3-(3-methoxyphenyl)phenyl]-N4-(3-pyrazolidin-1-ylpropyl)pyrimidine-2,4-diamine Openeye Name: N2-[3-(3-methoxyphenyl)phenyl]-N4-(3-pyrazolidin-1-ylpropyl)pyrimidine-2,4-diamine CAS Name: N2-[3-(3-methoxyphenyl)phenyl]-N4-[3-(1-pyrazolidinyl)propyl]pyrimidine-2,4-diamine IUPAC Name: 2-N-[3-(3-methoxyphenyl)phenyl]-4-N-(3-pyrazolidin-1-ylpropyl)pyrimidine-2,4-diamine Traditional Name: [2-[3-(3-methoxyphenyl)anilino]pyrimidin-4-yl]-(3-pyrazolidin-1-ylpropyl)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)NCCCN4CCCN4

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC(=CC=C2)NC3=NC=CC(=N3)NCCCN4CCCN4

InChI

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