1-(2-bromophenyl)-3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyrrolidin-1-ylcarbonyl-phenyl]urea

Systemtic Name: 1-(2-bromophenyl)-3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyrrolidin-1-ylcarbonyl-phenyl]urea Openeye Name: 1-(2-bromophenyl)-3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(pyrrolidine-1-carbonyl)phenyl]urea CAS Name: 1-(2-bromophenyl)-3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[oxo(1-pyrrolidinyl)methyl]phenyl]urea IUPAC Name: 1-(2-bromophenyl)-3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(pyrrolidine-1-carbonyl)phenyl]urea Traditional Name: 1-(2-bromophenyl)-3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(pyrrolidine-1-carbonyl)phenyl]urea Formula: C27H27BrN4O2 MolecularWeight: 519.43288

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=C(C=CC(=C2)NC(=O)NC3=CC=CC=C3Br)N4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CCN(C1)C(=O)C2=C(C=CC(=C2)NC(=O)NC3=CC=CC=C3Br)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C27H27BrN4O2/c28-23-9-3-4-10-24(23)30-27(34)29-21-11-12-25(22(17-21)26(33)31-14-5-6-15-31)32-16-13-19-7-1-2-8-20(19)18-32/h1-4,7-12,17H,5-6,13-16,18H2,(H2,29,30,34)