N-[[2-(1H-benzimidazol-2-ylmethoxy)-4-carbamimidoyl-phenyl]methyl]-2-[2,6-bis(fluoranyl)-4-methoxy-phenyl]-2-ethoxy-ethanamide hydrochloride

Systemtic Name: N-[[2-(1H-benzimidazol-2-ylmethoxy)-4-carbamimidoyl-phenyl]methyl]-2-[2,6-bis(fluoranyl)-4-methoxy-phenyl]-2-ethoxy-ethanamide hydrochloride Openeye Name: N-[[2-(1H-benzimidazol-2-ylmethoxy)-4-carbamimidoyl-phenyl]methyl]-2-(2,6-difluoro-4-methoxy-phenyl)-2-ethoxy-acetamide hydrochloride CAS Name: N-[[2-(1H-benzimidazol-2-ylmethoxy)-4-carbamimidoylphenyl]methyl]-2-(2,6-difluoro-4-methoxyphenyl)-2-ethoxyacetamide hydrochloride IUPAC Name: N-[[2-(1H-benzimidazol-2-ylmethoxy)-4-carbamimidoylphenyl]methyl]-2-(2,6-difluoro-4-methoxyphenyl)-2-ethoxyacetamide hydrochloride Traditional Name: N-[4-amidino-2-(1H-benzimidazol-2-ylmethoxy)benzyl]-2-(2,6-difluoro-4-methoxy-phenyl)-2-ethoxy-acetamide hydrochloride Formula: C27H28ClF2N5O4 MolecularWeight: 559.992126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1=C(C=C(C=C1F)OC)F)C(=O)NCC2=C(C=C(C=C2)C(=N)N)OCC3=NC4=CC=CC=C4N3.Cl

Isomeric SMILES

CCOC(C1=C(C=C(C=C1F)OC)F)C(=O)NCC2=C(C=C(C=C2)C(=N)N)OCC3=NC4=CC=CC=C4N3.Cl

InChI

InChI=1S/C27H27F2N5O4.ClH/c1-3-37-25(24-18(28)11-17(36-2)12-19(24)29)27(35)32-13-16-9-8-15(26(30)31)10-22(16)38-14-23-33-20-6-4-5-7-21(20)34-23;/h4-12,25H,3,13-14H2,1-2H3,(H3,30,31)(H,32,35)(H,33,34);1H