N2-[4-(2-piperidin-1-ylethoxy)phenyl]-N4-quinolin-3-yl-pyrimidine-2,4-diamine

Systemtic Name: N2-[4-(2-piperidin-1-ylethoxy)phenyl]-N4-quinolin-3-yl-pyrimidine-2,4-diamine Openeye Name: N2-[4-[2-(1-piperidyl)ethoxy]phenyl]-N4-(3-quinolyl)pyrimidine-2,4-diamine CAS Name: N2-[4-[2-(1-piperidinyl)ethoxy]phenyl]-N4-(3-quinolinyl)pyrimidine-2,4-diamine IUPAC Name: 2-N-[4-(2-piperidin-1-ylethoxy)phenyl]-4-N-quinolin-3-ylpyrimidine-2,4-diamine Traditional Name: [2-[4-(2-piperidinoethoxy)anilino]pyrimidin-4-yl]-(3-quinolyl)amine Formula: C26H28N6O MolecularWeight: 440.54012

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC2=CC=C(C=C2)NC3=NC=CC(=N3)NC4=CC5=CC=CC=C5N=C4

Isomeric SMILES

C1CCN(CC1)CCOC2=CC=C(C=C2)NC3=NC=CC(=N3)NC4=CC5=CC=CC=C5N=C4

InChI

InChI=1S/C26H28N6O/c1-4-14-32(15-5-1)16-17-33-23-10-8-21(9-11-23)30-26-27-13-12-25(31-26)29-22-18-20-6-2-3-7-24(20)28-19-22/h2-3,6-13,18-19H,1,4-5,14-17H2,(H2,27,29,30,31)