N-[(4-carbamimidoyl-2-fluoranyl-phenyl)methyl]-2-[3-[(3-methoxyphenyl)sulfonylamino]-2-oxidanylidene-pyridin-1-yl]ethanamide

Systemtic Name: N-[(4-carbamimidoyl-2-fluoranyl-phenyl)methyl]-2-[3-[(3-methoxyphenyl)sulfonylamino]-2-oxidanylidene-pyridin-1-yl]ethanamide Openeye Name: N-[(4-carbamimidoyl-2-fluoro-phenyl)methyl]-2-[3-[(3-methoxyphenyl)sulfonylamino]-2-oxo-1-pyridyl]acetamide CAS Name: N-[(4-carbamimidoyl-2-fluorophenyl)methyl]-2-[3-[(3-methoxyphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide IUPAC Name: N-[(4-carbamimidoyl-2-fluorophenyl)methyl]-2-[3-[(3-methoxyphenyl)sulfonylamino]-2-oxopyridin-1-yl]acetamide Traditional Name: N-(4-amidino-2-fluoro-benzyl)-2-[2-keto-3-[(3-methoxyphenyl)sulfonylamino]-1-pyridyl]acetamide Formula: C22H22FN5O5S MolecularWeight: 487.503983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)S(=O)(=O)NC2=CC=CN(C2=O)CC(=O)NCC3=C(C=C(C=C3)C(=N)N)F

Isomeric SMILES

COC1=CC(=CC=C1)S(=O)(=O)NC2=CC=CN(C2=O)CC(=O)NCC3=C(C=C(C=C3)C(=N)N)F

InChI

InChI=1S/C22H22FN5O5S/c1-33-16-4-2-5-17(11-16)34(31,32)27-19-6-3-9-28(22(19)30)13-20(29)26-12-15-8-7-14(21(24)25)10-18(15)23/h2-11,27H,12-13H2,1H3,(H3,24,25)(H,26,29)