1-[2-[1-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]-3-quinolin-4-yl-urea

Systemtic Name: 1-[2-[1-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]-3-quinolin-4-yl-urea Openeye Name: 1-[2-(1-benzyl-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-(4-quinolyl)urea CAS Name: 1-[2-[1-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]-3-(4-quinolinyl)urea IUPAC Name: 1-[2-(1-benzyl-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-quinolin-4-ylurea Traditional Name: 1-[2-(1-benzyl-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-(4-quinolyl)urea Formula: C28H28N4O MolecularWeight: 436.54812

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C2=CC=CC=C21)CC3=CC=CC=C3)CCNC(=O)NC4=CC=NC5=CC=CC=C54

Isomeric SMILES

C1CN(C(C2=CC=CC=C21)CC3=CC=CC=C3)CCNC(=O)NC4=CC=NC5=CC=CC=C54

InChI

InChI=1S/C28H28N4O/c33-28(31-26-14-16-29-25-13-7-6-12-24(25)26)30-17-19-32-18-15-22-10-4-5-11-23(22)27(32)20-21-8-2-1-3-9-21/h1-14,16,27H,15,17-20H2,(H2,29,30,31,33)