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

Systemtic Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-dimethylaminophenyl)ethyl]-3-phenethyl-urea Openeye Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-dimethylaminophenyl)ethyl]-3-phenethyl-urea CAS Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-dimethylaminophenyl)ethyl]-3-phenethylurea IUPAC Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-dimethylaminophenyl)ethyl]-3-phenethylurea Traditional Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-dimethylaminophenyl)ethyl]-3-phenethyl-urea Formula: C28H34N4O MolecularWeight: 442.59576

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNC(=O)NCCC2=CC=CC=C2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(CNC(=O)NCCC2=CC=CC=C2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C28H34N4O/c1-31(2)26-14-12-24(13-15-26)27(32-19-17-23-10-6-7-11-25(23)21-32)20-30-28(33)29-18-16-22-8-4-3-5-9-22/h3-15,27H,16-21H2,1-2H3,(H2,29,30,33)