2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-N-(N'-cyclopentylcarbamimidoyl)-3-fluoranyl-benzamide

Systemtic Name: 2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-N-(N'-cyclopentylcarbamimidoyl)-3-fluoranyl-benzamide Openeye Name: 2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-N-(N'-cyclopentylcarbamimidoyl)-3-fluoro-benzamide CAS Name: N-[amino(cyclopentylimino)methyl]-2-[2-(5-bromo-2-methoxyphenyl)ethyl]-3-fluorobenzamide IUPAC Name: 2-[2-(5-bromo-2-methoxyphenyl)ethyl]-N-(N'-cyclopentylcarbamimidoyl)-3-fluorobenzamide Traditional Name: 2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-N-(N'-cyclopentylamidino)-3-fluoro-benzamide Formula: C22H25BrFN3O2 MolecularWeight: 462.355203

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CCC2=C(C=CC=C2F)C(=O)NC(=NC3CCCC3)N

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CCC2=C(C=CC=C2F)C(=O)NC(=NC3CCCC3)N

InChI

InChI=1S/C22H25BrFN3O2/c1-29-20-12-10-15(23)13-14(20)9-11-17-18(7-4-8-19(17)24)21(28)27-22(25)26-16-5-2-3-6-16/h4,7-8,10,12-13,16H,2-3,5-6,9,11H2,1H3,(H3,25,26,27,28)