N-[8-fluoranyl-5-(2-phenoxyethyl)-[1,2,4]triazino[5,6-b]indol-3-yl]furan-2-carboxamide

Systemtic Name: N-[8-fluoranyl-5-(2-phenoxyethyl)-[1,2,4]triazino[5,6-b]indol-3-yl]furan-2-carboxamide Openeye Name: N-[8-fluoro-5-(2-phenoxyethyl)-[1,2,4]triazino[5,6-b]indol-3-yl]furan-2-carboxamide CAS Name: N-[8-fluoro-5-(2-phenoxyethyl)-[1,2,4]triazino[5,6-b]indol-3-yl]-2-furancarboxamide IUPAC Name: N-[8-fluoro-5-(2-phenoxyethyl)-[1,2,4]triazino[5,6-b]indol-3-yl]furan-2-carboxamide Traditional Name: N-[8-fluoro-5-(2-phenoxyethyl)-[1,2,4]triazin[5,6-b]indol-3-yl]-2-furamide Formula: C22H16FN5O3 MolecularWeight: 417.392543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCN2C3=C(C=C(C=C3)F)C4=C2N=C(N=N4)NC(=O)C5=CC=CO5

Isomeric SMILES

C1=CC=C(C=C1)OCCN2C3=C(C=C(C=C3)F)C4=C2N=C(N=N4)NC(=O)C5=CC=CO5

InChI

InChI=1S/C22H16FN5O3/c23-14-8-9-17-16(13-14)19-20(28(17)10-12-30-15-5-2-1-3-6-15)24-22(27-26-19)25-21(29)18-7-4-11-31-18/h1-9,11,13H,10,12H2,(H,24,25,27,29)