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

Systemtic Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-phenethyl-urea Openeye Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-phenethyl-urea CAS Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methyl-2-pyrrolyl)ethyl]-3-phenethylurea IUPAC Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-phenethylurea Traditional Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-phenethyl-urea Formula: C25H30N4O MolecularWeight: 402.5319

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(CNC(=O)NCCC2=CC=CC=C2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CN1C=CC=C1C(CNC(=O)NCCC2=CC=CC=C2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C25H30N4O/c1-28-16-7-12-23(28)24(29-17-14-21-10-5-6-11-22(21)19-29)18-27-25(30)26-15-13-20-8-3-2-4-9-20/h2-12,16,24H,13-15,17-19H2,1H3,(H2,26,27,30)