2-[(4-fluorophenyl)methylcarbamoylamino]-N-(5-piperidin-1-ylisoquinolin-8-yl)ethanamide

Systemtic Name: 2-[(4-fluorophenyl)methylcarbamoylamino]-N-(5-piperidin-1-ylisoquinolin-8-yl)ethanamide Openeye Name: 2-[(4-fluorophenyl)methylcarbamoylamino]-N-[5-(1-piperidyl)-8-isoquinolyl]acetamide CAS Name: 2-[[[(4-fluorophenyl)methylamino]-oxomethyl]amino]-N-[5-(1-piperidinyl)-8-isoquinolinyl]acetamide IUPAC Name: 2-[(4-fluorophenyl)methylcarbamoylamino]-N-(5-piperidin-1-ylisoquinolin-8-yl)acetamide Traditional Name: 2-[(4-fluorobenzyl)carbamoylamino]-N-(5-piperidino-8-isoquinolyl)acetamide Formula: C24H26FN5O2 MolecularWeight: 435.493943

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)CNC(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)CNC(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C24H26FN5O2/c25-18-6-4-17(5-7-18)14-27-24(32)28-16-23(31)29-21-8-9-22(30-12-2-1-3-13-30)19-10-11-26-15-20(19)21/h4-11,15H,1-3,12-14,16H2,(H,29,31)(H2,27,28,32)