3,4-dihydro-1H-isoquinolin-2-yl-[2-(pyridin-4-ylamino)-1,3-dihydroisoindol-5-yl]carbamic acid

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(pyridin-4-ylamino)-1,3-dihydroisoindol-5-yl]carbamic acid Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(4-pyridylamino)isoindolin-5-yl]carbamic acid CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(pyridin-4-ylamino)-1,3-dihydroisoindol-5-yl]carbamic acid IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(pyridin-4-ylamino)-1,3-dihydroisoindol-5-yl]carbamic acid Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(4-pyridylamino)isoindolin-5-yl]carbamic acid Formula: C23H23N5O2 MolecularWeight: 401.46102

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)N(C3=CC4=C(CN(C4)NC5=CC=NC=C5)C=C3)C(=O)O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)N(C3=CC4=C(CN(C4)NC5=CC=NC=C5)C=C3)C(=O)O

InChI

InChI=1S/C23H23N5O2/c29-23(30)28(27-12-9-17-3-1-2-4-18(17)16-27)22-6-5-19-14-26(15-20(19)13-22)25-21-7-10-24-11-8-21/h1-8,10-11,13H,9,12,14-16H2,(H,24,25)(H,29,30)