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

Systemtic Name: N2-[3-(3-methoxyphenyl)phenyl]-N4-(3-piperazin-1-ylpropyl)pyrimidine-2,4-diamine Openeye Name: N2-[3-(3-methoxyphenyl)phenyl]-N4-(3-piperazin-1-ylpropyl)pyrimidine-2,4-diamine CAS Name: N2-[3-(3-methoxyphenyl)phenyl]-N4-[3-(1-piperazinyl)propyl]pyrimidine-2,4-diamine IUPAC Name: 2-N-[3-(3-methoxyphenyl)phenyl]-4-N-(3-piperazin-1-ylpropyl)pyrimidine-2,4-diamine Traditional Name: [2-[3-(3-methoxyphenyl)anilino]pyrimidin-4-yl]-(3-piperazinopropyl)amine Formula: C24H30N6O MolecularWeight: 418.5346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CC(=CC=C2)NC3=NC=CC(=N3)NCCCN4CCNCC4

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC(=CC=C2)NC3=NC=CC(=N3)NCCCN4CCNCC4

InChI

InChI=1S/C24H30N6O/c1-31-22-8-3-6-20(18-22)19-5-2-7-21(17-19)28-24-27-11-9-23(29-24)26-10-4-14-30-15-12-25-13-16-30/h2-3,5-9,11,17-18,25H,4,10,12-16H2,1H3,(H2,26,27,28,29)