6-(3-azanylpropyl)-4-phenyl-9-(1H-pyrazol-4-yl)-2H-benzo[h]isoquinolin-1-one

Systemtic Name: 6-(3-azanylpropyl)-4-phenyl-9-(1H-pyrazol-4-yl)-2H-benzo[h]isoquinolin-1-one Openeye Name: 6-(3-aminopropyl)-4-phenyl-9-(1H-pyrazol-4-yl)-2H-benzo[h]isoquinolin-1-one CAS Name: 6-(3-aminopropyl)-4-phenyl-9-(1H-pyrazol-4-yl)-2H-benzo[h]isoquinolin-1-one IUPAC Name: 6-(3-aminopropyl)-4-phenyl-9-(1H-pyrazol-4-yl)-2H-benzo[h]isoquinolin-1-one Traditional Name: 6-(3-aminopropyl)-4-phenyl-9-(1H-pyrazol-4-yl)-2H-benz[h]isoquinolin-1-one Formula: C25H22N4O MolecularWeight: 394.46838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CNC(=O)C3=C4C=C(C=CC4=C(C=C23)CCCN)C5=CNN=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=CNC(=O)C3=C4C=C(C=CC4=C(C=C23)CCCN)C5=CNN=C5

InChI

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