N-[(4-carbamimidoylphenyl)methyl]-2-[2-fluoranyl-4-(2-methylpropoxy)phenyl]-2-methoxy-ethanamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-fluoranyl-4-(2-methylpropoxy)phenyl]-2-methoxy-ethanamide Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-2-(2-fluoro-4-isobutoxy-phenyl)-2-methoxy-acetamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-fluoro-4-(2-methylpropoxy)phenyl]-2-methoxyacetamide IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-fluoro-4-(2-methylpropoxy)phenyl]-2-methoxyacetamide Traditional Name: N-(4-amidinobenzyl)-2-(2-fluoro-4-isobutoxy-phenyl)-2-methoxy-acetamide Formula: C21H26FN3O3 MolecularWeight: 387.447843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC(=C(C=C1)C(C(=O)NCC2=CC=C(C=C2)C(=N)N)OC)F

Isomeric SMILES

CC(C)COC1=CC(=C(C=C1)C(C(=O)NCC2=CC=C(C=C2)C(=N)N)OC)F

InChI

InChI=1S/C21H26FN3O3/c1-13(2)12-28-16-8-9-17(18(22)10-16)19(27-3)21(26)25-11-14-4-6-15(7-5-14)20(23)24/h4-10,13,19H,11-12H2,1-3H3,(H3,23,24)(H,25,26)