2-(4-bromanyl-2-fluoranyl-phenyl)-N-[(4-carbamimidoylphenyl)methyl]-2-propoxy-ethanamide

Systemtic Name: 2-(4-bromanyl-2-fluoranyl-phenyl)-N-[(4-carbamimidoylphenyl)methyl]-2-propoxy-ethanamide Openeye Name: 2-(4-bromo-2-fluoro-phenyl)-N-[(4-carbamimidoylphenyl)methyl]-2-propoxy-acetamide CAS Name: 2-(4-bromo-2-fluorophenyl)-N-[(4-carbamimidoylphenyl)methyl]-2-propoxyacetamide IUPAC Name: 2-(4-bromo-2-fluorophenyl)-N-[(4-carbamimidoylphenyl)methyl]-2-propoxyacetamide Traditional Name: N-(4-amidinobenzyl)-2-(4-bromo-2-fluoro-phenyl)-2-propoxy-acetamide Formula: C19H21BrFN3O2 MolecularWeight: 422.291343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(C1=C(C=C(C=C1)Br)F)C(=O)NCC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CCCOC(C1=C(C=C(C=C1)Br)F)C(=O)NCC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C19H21BrFN3O2/c1-2-9-26-17(15-8-7-14(20)10-16(15)21)19(25)24-11-12-3-5-13(6-4-12)18(22)23/h3-8,10,17H,2,9,11H2,1H3,(H3,22,23)(H,24,25)