N-[[4-carbamimidoyl-2-[2-(methylsulfonylamino)ethoxy]phenyl]methyl]-4-fluoranyl-3-methyl-benzamide

Systemtic Name: N-[[4-carbamimidoyl-2-[2-(methylsulfonylamino)ethoxy]phenyl]methyl]-4-fluoranyl-3-methyl-benzamide Openeye Name: N-[[4-carbamimidoyl-2-[2-(methanesulfonamido)ethoxy]phenyl]methyl]-4-fluoro-3-methyl-benzamide CAS Name: N-[[4-carbamimidoyl-2-[2-(methanesulfonamido)ethoxy]phenyl]methyl]-4-fluoro-3-methylbenzamide IUPAC Name: N-[[4-carbamimidoyl-2-[2-(methanesulfonamido)ethoxy]phenyl]methyl]-4-fluoro-3-methylbenzamide Traditional Name: N-[4-amidino-2-[2-(methanesulfonamido)ethoxy]benzyl]-4-fluoro-3-methyl-benzamide Formula: C19H23FN4O4S MolecularWeight: 422.473723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC2=C(C=C(C=C2)C(=N)N)OCCNS(=O)(=O)C)F

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCC2=C(C=C(C=C2)C(=N)N)OCCNS(=O)(=O)C)F

InChI

InChI=1S/C19H23FN4O4S/c1-12-9-14(5-6-16(12)20)19(25)23-11-15-4-3-13(18(21)22)10-17(15)28-8-7-24-29(2,26)27/h3-6,9-10,24H,7-8,11H2,1-2H3,(H3,21,22)(H,23,25)