(3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene)-5-(5-fluoranyl-2-oxidanyl-phenyl)-N-(furan-2-ylmethyl)-4-oxidanylidene-cyclohexa-1,5-diene-1-carboxamide

Systemtic Name: (3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene)-5-(5-fluoranyl-2-oxidanyl-phenyl)-N-(furan-2-ylmethyl)-4-oxidanylidene-cyclohexa-1,5-diene-1-carboxamide Openeye Name: (3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene)-5-(5-fluoro-2-hydroxy-phenyl)-N-(2-furylmethyl)-4-oxo-cyclohexa-1,5-diene-1-carboxamide CAS Name: (3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene)-5-(5-fluoro-2-hydroxyphenyl)-N-(2-furanylmethyl)-4-oxo-1-cyclohexa-1,5-dienecarboxamide IUPAC Name: (3E)-3-(5-carbamimidoyl-1,3-dihydrobenzimidazol-2-ylidene)-5-(5-fluoro-2-hydroxyphenyl)-N-(furan-2-ylmethyl)-4-oxocyclohexa-1,5-diene-1-carboxamide Traditional Name: (3E)-3-(5-amidino-1,3-dihydrobenzimidazol-2-ylidene)-5-(5-fluoro-2-hydroxy-phenyl)-N-(2-furfuryl)-4-keto-cyclohexa-1,5-diene-1-carboxamide Formula: C26H20FN5O4 MolecularWeight: 485.466503

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(=O)C2=CC(=C3NC4=C(N3)C=C(C=C4)C(=N)N)C(=O)C(=C2)C5=C(C=CC(=C5)F)O

Isomeric SMILES

C1=COC(=C1)CNC(=O)C2=C/C(=C\3/NC4=C(N3)C=C(C=C4)C(=N)N)/C(=O)C(=C2)C5=C(C=CC(=C5)F)O

InChI

InChI=1S/C26H20FN5O4/c27-15-4-6-22(33)17(11-15)18-8-14(26(35)30-12-16-2-1-7-36-16)9-19(23(18)34)25-31-20-5-3-13(24(28)29)10-21(20)32-25/h1-11,31-33H,12H2,(H3,28,29)(H,30,35)/b25-19+