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

Systemtic Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]urea CAS Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methyl-2-pyrrolyl)ethyl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]urea Traditional Name: 1-benzyl-3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]urea Formula: C24H28N4O MolecularWeight: 388.50532

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(CNC(=O)NCC2=CC=CC=C2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CN1C=CC=C1C(CNC(=O)NCC2=CC=CC=C2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C24H28N4O/c1-27-14-7-12-22(27)23(28-15-13-20-10-5-6-11-21(20)18-28)17-26-24(29)25-16-19-8-3-2-4-9-19/h2-12,14,23H,13,15-18H2,1H3,(H2,25,26,29)