N-[4-[3-(2-azanylpyrimidin-4-yl)pyridin-2-yl]oxyphenyl]-4-phenyl-isoquinolin-1-amine

Systemtic Name: N-[4-[3-(2-azanylpyrimidin-4-yl)pyridin-2-yl]oxyphenyl]-4-phenyl-isoquinolin-1-amine Openeye Name: N-[4-[[3-(2-aminopyrimidin-4-yl)-2-pyridyl]oxy]phenyl]-4-phenyl-isoquinolin-1-amine CAS Name: N-[4-[[3-(2-amino-4-pyrimidinyl)-2-pyridinyl]oxy]phenyl]-4-phenyl-1-isoquinolinamine IUPAC Name: N-[4-[3-(2-aminopyrimidin-4-yl)pyridin-2-yl]oxyphenyl]-4-phenylisoquinolin-1-amine Traditional Name: [4-[[3-(2-aminopyrimidin-4-yl)-2-pyridyl]oxy]phenyl]-(4-phenyl-1-isoquinolyl)amine Formula: C30H22N6O MolecularWeight: 482.53528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)OC5=C(C=CC=N5)C6=NC(=NC=C6)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)OC5=C(C=CC=N5)C6=NC(=NC=C6)N

InChI

InChI=1S/C30H22N6O/c31-30-33-18-16-27(36-30)25-11-6-17-32-29(25)37-22-14-12-21(13-15-22)35-28-24-10-5-4-9-23(24)26(19-34-28)20-7-2-1-3-8-20/h1-19H,(H,34,35)(H2,31,33,36)