6-(3-azanylpropyl)-4-(1H-indol-5-yl)-9-(1H-pyrazol-4-yl)-2H-benzo[h]isoquinolin-1-one

Systemtic Name: 6-(3-azanylpropyl)-4-(1H-indol-5-yl)-9-(1H-pyrazol-4-yl)-2H-benzo[h]isoquinolin-1-one Openeye Name: 6-(3-aminopropyl)-4-(1H-indol-5-yl)-9-(1H-pyrazol-4-yl)-2H-benzo[h]isoquinolin-1-one CAS Name: 6-(3-aminopropyl)-4-(1H-indol-5-yl)-9-(1H-pyrazol-4-yl)-2H-benzo[h]isoquinolin-1-one IUPAC Name: 6-(3-aminopropyl)-4-(1H-indol-5-yl)-9-(1H-pyrazol-4-yl)-2H-benzo[h]isoquinolin-1-one Traditional Name: 6-(3-aminopropyl)-4-(1H-indol-5-yl)-9-(1H-pyrazol-4-yl)-2H-benz[h]isoquinolin-1-one Formula: C27H23N5O MolecularWeight: 433.50442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C3C(=CNC(=O)C3=C2C=C1C4=CNN=C4)C5=CC6=C(C=C5)NC=C6)CCCN

Isomeric SMILES

C1=CC2=C(C=C3C(=CNC(=O)C3=C2C=C1C4=CNN=C4)C5=CC6=C(C=C5)NC=C6)CCCN

InChI

InChI=1S/C27H23N5O/c28-8-1-2-17-12-23-24(18-4-6-25-19(10-18)7-9-29-25)15-30-27(33)26(23)22-11-16(3-5-21(17)22)20-13-31-32-14-20/h3-7,9-15,29H,1-2,8,28H2,(H,30,33)(H,31,32)