6-[5-[2-azanyl-3-(1H-indol-3-yl)propoxy]pyridin-3-yl]-2H-isoquinolin-1-one

Systemtic Name: 6-[5-[2-azanyl-3-(1H-indol-3-yl)propoxy]pyridin-3-yl]-2H-isoquinolin-1-one Openeye Name: 6-[5-[2-amino-3-(1H-indol-3-yl)propoxy]-3-pyridyl]-2H-isoquinolin-1-one CAS Name: 6-[5-[2-amino-3-(1H-indol-3-yl)propoxy]-3-pyridinyl]-2H-isoquinolin-1-one IUPAC Name: 6-[5-[2-amino-3-(1H-indol-3-yl)propoxy]pyridin-3-yl]-2H-isoquinolin-1-one Traditional Name: 6-[5-[2-amino-3-(1H-indol-3-yl)propoxy]-3-pyridyl]isocarbostyril Formula: C25H22N4O2 MolecularWeight: 410.46778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(COC3=CN=CC(=C3)C4=CC5=C(C=C4)C(=O)NC=C5)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(COC3=CN=CC(=C3)C4=CC5=C(C=C4)C(=O)NC=C5)N

InChI

InChI=1S/C25H22N4O2/c26-20(10-19-13-29-24-4-2-1-3-22(19)24)15-31-21-11-18(12-27-14-21)16-5-6-23-17(9-16)7-8-28-25(23)30/h1-9,11-14,20,29H,10,15,26H2,(H,28,30)