N-[(4-carbamimidoylphenyl)methyl]-2-[5-ethoxy-2-fluoranyl-3-(1-methylpiperidin-4-yl)oxy-phenyl]-2-methoxy-ethanamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-ethoxy-2-fluoranyl-3-(1-methylpiperidin-4-yl)oxy-phenyl]-2-methoxy-ethanamide Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-ethoxy-2-fluoro-3-[(1-methyl-4-piperidyl)oxy]phenyl]-2-methoxy-acetamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-ethoxy-2-fluoro-3-[(1-methyl-4-piperidinyl)oxy]phenyl]-2-methoxyacetamide IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-2-[5-ethoxy-2-fluoro-3-(1-methylpiperidin-4-yl)oxyphenyl]-2-methoxyacetamide Traditional Name: N-(4-amidinobenzyl)-2-[5-ethoxy-2-fluoro-3-[(1-methyl-4-piperidyl)oxy]phenyl]-2-methoxy-acetamide Formula: C25H33FN4O4 MolecularWeight: 472.552323

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C(=C1)C(C(=O)NCC2=CC=C(C=C2)C(=N)N)OC)F)OC3CCN(CC3)C

Isomeric SMILES

CCOC1=CC(=C(C(=C1)C(C(=O)NCC2=CC=C(C=C2)C(=N)N)OC)F)OC3CCN(CC3)C

InChI

InChI=1S/C25H33FN4O4/c1-4-33-19-13-20(22(26)21(14-19)34-18-9-11-30(2)12-10-18)23(32-3)25(31)29-15-16-5-7-17(8-6-16)24(27)28/h5-8,13-14,18,23H,4,9-12,15H2,1-3H3,(H3,27,28)(H,29,31)