4-[2-[1-[(3-bromanyl-4-ethyl-phenyl)amino]isoquinolin-4-yl]ethyl]-1H-pyridin-2-one

Systemtic Name: 4-[2-[1-[(3-bromanyl-4-ethyl-phenyl)amino]isoquinolin-4-yl]ethyl]-1H-pyridin-2-one Openeye Name: 4-[2-[1-(3-bromo-4-ethyl-anilino)-4-isoquinolyl]ethyl]-1H-pyridin-2-one CAS Name: 4-[2-[1-(3-bromo-4-ethylanilino)-4-isoquinolinyl]ethyl]-1H-pyridin-2-one IUPAC Name: 4-[2-[1-(3-bromo-4-ethylanilino)isoquinolin-4-yl]ethyl]-1H-pyridin-2-one Traditional Name: 4-[2-[1-(3-bromo-4-ethyl-anilino)-4-isoquinolyl]ethyl]-2-pyridone Formula: C24H22BrN3O MolecularWeight: 448.35498

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)NC2=NC=C(C3=CC=CC=C32)CCC4=CC(=O)NC=C4)Br

Isomeric SMILES

CCC1=C(C=C(C=C1)NC2=NC=C(C3=CC=CC=C32)CCC4=CC(=O)NC=C4)Br

InChI

InChI=1S/C24H22BrN3O/c1-2-17-9-10-19(14-22(17)25)28-24-21-6-4-3-5-20(21)18(15-27-24)8-7-16-11-12-26-23(29)13-16/h3-6,9-15H,2,7-8H2,1H3,(H,26,29)(H,27,28)