N-[4-[3-(2-azanylpyrimidin-4-yl)pyridin-2-yl]oxyphenyl]-4-cyclohexyl-phthalazin-1-amine

Systemtic Name: N-[4-[3-(2-azanylpyrimidin-4-yl)pyridin-2-yl]oxyphenyl]-4-cyclohexyl-phthalazin-1-amine Openeye Name: N-[4-[[3-(2-aminopyrimidin-4-yl)-2-pyridyl]oxy]phenyl]-4-cyclohexyl-phthalazin-1-amine CAS Name: N-[4-[[3-(2-amino-4-pyrimidinyl)-2-pyridinyl]oxy]phenyl]-4-cyclohexyl-1-phthalazinamine IUPAC Name: N-[4-[3-(2-aminopyrimidin-4-yl)pyridin-2-yl]oxyphenyl]-4-cyclohexylphthalazin-1-amine Traditional Name: [4-[[3-(2-aminopyrimidin-4-yl)-2-pyridyl]oxy]phenyl]-(4-cyclohexylphthalazin-1-yl)amine Formula: C29H27N7O MolecularWeight: 489.57098

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)OC5=C(C=CC=N5)C6=NC(=NC=C6)N

Isomeric SMILES

C1CCC(CC1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)OC5=C(C=CC=N5)C6=NC(=NC=C6)N

InChI

InChI=1S/C29H27N7O/c30-29-32-18-16-25(34-29)24-11-6-17-31-28(24)37-21-14-12-20(13-15-21)33-27-23-10-5-4-9-22(23)26(35-36-27)19-7-2-1-3-8-19/h4-6,9-19H,1-3,7-8H2,(H,33,36)(H2,30,32,34)