2-(3-carbamimidoylphenoxy)-N-[2-fluoranyl-4-(2-methylsulfonylphenyl)phenyl]benzamide

Systemtic Name: 2-(3-carbamimidoylphenoxy)-N-[2-fluoranyl-4-(2-methylsulfonylphenyl)phenyl]benzamide Openeye Name: 2-(3-carbamimidoylphenoxy)-N-[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]benzamide CAS Name: 2-(3-carbamimidoylphenoxy)-N-[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]benzamide IUPAC Name: 2-(3-carbamimidoylphenoxy)-N-[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]benzamide Traditional Name: 2-(3-amidinophenoxy)-N-[2-fluoro-4-(2-mesylphenyl)phenyl]benzamide Formula: C27H22FN3O4S MolecularWeight: 503.544683

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3OC4=CC=CC(=C4)C(=N)N)F

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3OC4=CC=CC(=C4)C(=N)N)F

InChI

InChI=1S/C27H22FN3O4S/c1-36(33,34)25-12-5-3-9-20(25)17-13-14-23(22(28)16-17)31-27(32)21-10-2-4-11-24(21)35-19-8-6-7-18(15-19)26(29)30/h2-16H,1H3,(H3,29,30)(H,31,32)