4-phenyl-N-[6-[3-[2-(3-piperidin-1-ylpropylamino)pyrimidin-4-yl]pyridin-2-yl]oxypyridin-3-yl]phthalazin-1-amine

Systemtic Name: 4-phenyl-N-[6-[3-[2-(3-piperidin-1-ylpropylamino)pyrimidin-4-yl]pyridin-2-yl]oxypyridin-3-yl]phthalazin-1-amine Openeye Name: 4-phenyl-N-[6-[[3-[2-[3-(1-piperidyl)propylamino]pyrimidin-4-yl]-2-pyridyl]oxy]-3-pyridyl]phthalazin-1-amine CAS Name: 4-phenyl-N-[6-[[3-[2-[3-(1-piperidinyl)propylamino]-4-pyrimidinyl]-2-pyridinyl]oxy]-3-pyridinyl]-1-phthalazinamine IUPAC Name: 4-phenyl-N-[6-[3-[2-(3-piperidin-1-ylpropylamino)pyrimidin-4-yl]pyridin-2-yl]oxypyridin-3-yl]phthalazin-1-amine Traditional Name: (4-phenylphthalazin-1-yl)-[6-[[3-[2-(3-piperidinopropylamino)pyrimidin-4-yl]-2-pyridyl]oxy]-3-pyridyl]amine Formula: C36H35N9O MolecularWeight: 609.7228

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCNC2=NC=CC(=N2)C3=C(N=CC=C3)OC4=NC=C(C=C4)NC5=NN=C(C6=CC=CC=C65)C7=CC=CC=C7

Isomeric SMILES

C1CCN(CC1)CCCNC2=NC=CC(=N2)C3=C(N=CC=C3)OC4=NC=C(C=C4)NC5=NN=C(C6=CC=CC=C65)C7=CC=CC=C7

InChI

InChI=1S/C36H35N9O/c1-3-11-26(12-4-1)33-28-13-5-6-14-29(28)34(44-43-33)41-27-16-17-32(40-25-27)46-35-30(15-9-19-37-35)31-18-21-39-36(42-31)38-20-10-24-45-22-7-2-8-23-45/h1,3-6,9,11-19,21,25H,2,7-8,10,20,22-24H2,(H,41,44)(H,38,39,42)