4-acetamido-N-[N-(4-fluorophenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]benzamide

Systemtic Name: 4-acetamido-N-[N-(4-fluorophenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]benzamide Openeye Name: 4-acetamido-N-[N-(4-fluorophenyl)-N'-(4-pyridylmethyl)carbamimidoyl]benzamide CAS Name: 4-acetamido-N-[(4-fluoroanilino)-(pyridin-4-ylmethylimino)methyl]benzamide IUPAC Name: 4-acetamido-N-[N-(4-fluorophenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]benzamide Traditional Name: 4-acetamido-N-[N-(4-fluorophenyl)-N'-(4-pyridylmethyl)amidino]benzamide Formula: C22H20FN5O2 MolecularWeight: 405.424903

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)NC(=NCC2=CC=NC=C2)NC3=CC=C(C=C3)F

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)NC(=NCC2=CC=NC=C2)NC3=CC=C(C=C3)F

InChI

InChI=1S/C22H20FN5O2/c1-15(29)26-19-6-2-17(3-7-19)21(30)28-22(25-14-16-10-12-24-13-11-16)27-20-8-4-18(23)5-9-20/h2-13H,14H2,1H3,(H,26,29)(H2,25,27,28,30)