2-[2-(5-bromanyl-1-benzofuran-7-yl)ethyl]-3-fluoranyl-N-[N'-(5-piperidin-1-ylpentyl)carbamimidoyl]benzamide

Systemtic Name: 2-[2-(5-bromanyl-1-benzofuran-7-yl)ethyl]-3-fluoranyl-N-[N'-(5-piperidin-1-ylpentyl)carbamimidoyl]benzamide Openeye Name: 2-[2-(5-bromobenzofuran-7-yl)ethyl]-3-fluoro-N-[N'-[5-(1-piperidyl)pentyl]carbamimidoyl]benzamide CAS Name: N-[amino-[5-(1-piperidinyl)pentylimino]methyl]-2-[2-(5-bromo-7-benzofuranyl)ethyl]-3-fluorobenzamide IUPAC Name: 2-[2-(5-bromo-1-benzofuran-7-yl)ethyl]-3-fluoro-N-[N'-(5-piperidin-1-ylpentyl)carbamimidoyl]benzamide Traditional Name: 2-[2-(5-bromobenzofuran-7-yl)ethyl]-3-fluoro-N-[N'-(5-piperidinopentyl)amidino]benzamide Formula: C28H34BrFN4O2 MolecularWeight: 557.497563

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCCCN=C(N)NC(=O)C2=C(C(=CC=C2)F)CCC3=C4C(=CC(=C3)Br)C=CO4

Isomeric SMILES

C1CCN(CC1)CCCCCN=C(N)NC(=O)C2=C(C(=CC=C2)F)CCC3=C4C(=CC(=C3)Br)C=CO4

InChI

InChI=1S/C28H34BrFN4O2/c29-22-18-20(26-21(19-22)12-17-36-26)10-11-23-24(8-7-9-25(23)30)27(35)33-28(31)32-13-3-1-4-14-34-15-5-2-6-16-34/h7-9,12,17-19H,1-6,10-11,13-16H2,(H3,31,32,33,35)