1-[2-[6-methoxy-1-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]-3-quinolin-4-yl-urea

Systemtic Name: 1-[2-[6-methoxy-1-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]-3-quinolin-4-yl-urea Openeye Name: 1-[2-(1-benzyl-6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-(4-quinolyl)urea CAS Name: 1-[2-[6-methoxy-1-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]-3-(4-quinolinyl)urea IUPAC Name: 1-[2-(1-benzyl-6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-quinolin-4-ylurea Traditional Name: 1-[2-(1-benzyl-6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-(4-quinolyl)urea Formula: C29H30N4O2 MolecularWeight: 466.5741

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(N(CC2)CCNC(=O)NC3=CC=NC4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)C(N(CC2)CCNC(=O)NC3=CC=NC4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C29H30N4O2/c1-35-23-11-12-24-22(20-23)14-17-33(28(24)19-21-7-3-2-4-8-21)18-16-31-29(34)32-27-13-15-30-26-10-6-5-9-25(26)27/h2-13,15,20,28H,14,16-19H2,1H3,(H2,30,31,32,34)