3-[[6-(3-carbamimidoylphenoxy)-3,5-bis(fluoranyl)-4-methyl-pyridin-2-yl]-methyl-amino]benzenecarboximidamide

Systemtic Name: 3-[[6-(3-carbamimidoylphenoxy)-3,5-bis(fluoranyl)-4-methyl-pyridin-2-yl]-methyl-amino]benzenecarboximidamide Openeye Name: 3-[[6-(3-carbamimidoylphenoxy)-3,5-difluoro-4-methyl-2-pyridyl]-methyl-amino]benzamidine CAS Name: 3-[[6-(3-carbamimidoylphenoxy)-3,5-difluoro-4-methyl-2-pyridinyl]-methylamino]benzenecarboximidamide IUPAC Name: 3-[[6-(3-carbamimidoylphenoxy)-3,5-difluoro-4-methylpyridin-2-yl]-methylamino]benzenecarboximidamide Traditional Name: 3-[[6-(3-amidinophenoxy)-3,5-difluoro-4-methyl-2-pyridyl]-methyl-amino]benzamidine Formula: C21H20F2N6O MolecularWeight: 410.419906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=C1F)OC2=CC=CC(=C2)C(=N)N)N(C)C3=CC=CC(=C3)C(=N)N)F

Isomeric SMILES

CC1=C(C(=NC(=C1F)OC2=CC=CC(=C2)C(=N)N)N(C)C3=CC=CC(=C3)C(=N)N)F

InChI

InChI=1S/C21H20F2N6O/c1-11-16(22)20(29(2)14-7-3-5-12(9-14)18(24)25)28-21(17(11)23)30-15-8-4-6-13(10-15)19(26)27/h3-10H,1-2H3,(H3,24,25)(H3,26,27)