1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(naphthalen-1-ylmethyl)urea

Systemtic Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(naphthalen-1-ylmethyl)urea Openeye Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(1-naphthylmethyl)urea CAS Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methyl-2-pyrrolyl)ethyl]-3-(1-naphthalenylmethyl)urea IUPAC Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(naphthalen-1-ylmethyl)urea Traditional Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(1-naphthylmethyl)urea Formula: C28H30N4O MolecularWeight: 438.564

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(CNC(=O)NCC2=CC=CC3=CC=CC=C32)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CN1C=CC=C1C(CNC(=O)NCC2=CC=CC3=CC=CC=C32)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C28H30N4O/c1-31-16-7-14-26(31)27(32-17-15-21-8-2-3-10-24(21)20-32)19-30-28(33)29-18-23-12-6-11-22-9-4-5-13-25(22)23/h2-14,16,27H,15,17-20H2,1H3,(H2,29,30,33)