1H-isoindol-5-yl N-(4-fluoranyl-3,4-dihydro-1H-isoquinolin-2-yl)-N-(pyridin-4-ylamino)carbamate

Systemtic Name: 1H-isoindol-5-yl N-(4-fluoranyl-3,4-dihydro-1H-isoquinolin-2-yl)-N-(pyridin-4-ylamino)carbamate Openeye Name: 1H-isoindol-5-yl N-(4-fluoro-3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-pyridylamino)carbamate CAS Name: N-(4-fluoro-3,4-dihydro-1H-isoquinolin-2-yl)-N-(pyridin-4-ylamino)carbamic acid 1H-isoindol-5-yl ester IUPAC Name: 1H-isoindol-5-yl N-(4-fluoro-3,4-dihydro-1H-isoquinolin-2-yl)-N-(pyridin-4-ylamino)carbamate Traditional Name: N-(4-fluoro-3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-pyridylamino)carbamic acid 1H-isoindol-5-yl ester Formula: C23H20FN5O2 MolecularWeight: 417.435603

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC=C2CN1N(C(=O)OC3=CC4=C(CN=C4)C=C3)NC5=CC=NC=C5)F

Isomeric SMILES

C1C(C2=CC=CC=C2CN1N(C(=O)OC3=CC4=C(CN=C4)C=C3)NC5=CC=NC=C5)F

InChI

InChI=1S/C23H20FN5O2/c24-22-15-28(14-17-3-1-2-4-21(17)22)29(27-19-7-9-25-10-8-19)23(30)31-20-6-5-16-12-26-13-18(16)11-20/h1-11,13,22H,12,14-15H2,(H,25,27)