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

Systemtic Name: 4-[2-[1-[(3-methyl-4-propan-2-yl-phenyl)amino]isoquinolin-4-yl]ethyl]-1H-pyridin-2-one Openeye Name: 4-[2-[1-(4-isopropyl-3-methyl-anilino)-4-isoquinolyl]ethyl]-1H-pyridin-2-one CAS Name: 4-[2-[1-(3-methyl-4-propan-2-ylanilino)-4-isoquinolinyl]ethyl]-1H-pyridin-2-one IUPAC Name: 4-[2-[1-(3-methyl-4-propan-2-ylanilino)isoquinolin-4-yl]ethyl]-1H-pyridin-2-one Traditional Name: 4-[2-[1-(4-isopropyl-3-methyl-anilino)-4-isoquinolyl]ethyl]-2-pyridone Formula: C26H27N3O MolecularWeight: 397.51208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC=C(C3=CC=CC=C32)CCC4=CC(=O)NC=C4)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC=C(C3=CC=CC=C32)CCC4=CC(=O)NC=C4)C(C)C

InChI

InChI=1S/C26H27N3O/c1-17(2)22-11-10-21(14-18(22)3)29-26-24-7-5-4-6-23(24)20(16-28-26)9-8-19-12-13-27-25(30)15-19/h4-7,10-17H,8-9H2,1-3H3,(H,27,30)(H,28,29)