N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-1-[(phenylmethyl)carbamoylamino]cyclopentane-1-carboxamide

Systemtic Name: N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-1-[(phenylmethyl)carbamoylamino]cyclopentane-1-carboxamide Openeye Name: 1-(benzylcarbamoylamino)-N-[(5-bromo-2-fluoro-phenyl)methyl]cyclopentanecarboxamide CAS Name: N-[(5-bromo-2-fluorophenyl)methyl]-1-[[oxo-[(phenylmethyl)amino]methyl]amino]-1-cyclopentanecarboxamide IUPAC Name: 1-(benzylcarbamoylamino)-N-[(5-bromo-2-fluorophenyl)methyl]cyclopentane-1-carboxamide Traditional Name: 1-(benzylcarbamoylamino)-N-(5-bromo-2-fluoro-benzyl)cyclopentanecarboxamide Formula: C21H23BrFN3O2 MolecularWeight: 448.328623

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C(=O)NCC2=C(C=CC(=C2)Br)F)NC(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CCC(C1)(C(=O)NCC2=C(C=CC(=C2)Br)F)NC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H23BrFN3O2/c22-17-8-9-18(23)16(12-17)14-24-19(27)21(10-4-5-11-21)26-20(28)25-13-15-6-2-1-3-7-15/h1-3,6-9,12H,4-5,10-11,13-14H2,(H,24,27)(H2,25,26,28)