(2S)-1-(3H-indol-3-yl)-3-(5-isoquinolin-6-ylpyridin-3-yl)oxy-propan-2-amine

Systemtic Name: (2S)-1-(3H-indol-3-yl)-3-(5-isoquinolin-6-ylpyridin-3-yl)oxy-propan-2-amine Openeye Name: (2S)-1-(3H-indol-3-yl)-3-[[5-(6-isoquinolyl)-3-pyridyl]oxy]propan-2-amine CAS Name: (2S)-1-(3H-indol-3-yl)-3-[[5-(6-isoquinolinyl)-3-pyridinyl]oxy]-2-propanamine IUPAC Name: (2S)-1-(3H-indol-3-yl)-3-(5-isoquinolin-6-ylpyridin-3-yl)oxypropan-2-amine Traditional Name: [(1S)-1-(3H-indol-3-ylmethyl)-2-[[5-(6-isoquinolyl)-3-pyridyl]oxy]ethyl]amine Formula: C25H22N4O MolecularWeight: 394.46838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C=N2)CC(COC3=CN=CC(=C3)C4=CC5=C(C=C4)C=NC=C5)N

Isomeric SMILES

C1=CC=C2C(=C1)C(C=N2)C[C@@H](COC3=CN=CC(=C3)C4=CC5=C(C=C4)C=NC=C5)N

InChI

InChI=1S/C25H22N4O/c26-22(10-21-14-29-25-4-2-1-3-24(21)25)16-30-23-11-20(13-28-15-23)17-5-6-19-12-27-8-7-18(19)9-17/h1-9,11-15,21-22H,10,16,26H2/t21?,22-/m0/s1