4-azanyl-5-[3-fluoranyl-4-[[6-(phenylcarbonyl)-1H-benzimidazol-2-yl]amino]phenyl]-N-[2,2,2-tris(fluoranyl)ethyl]pyrrolo[2,1-f][1,2,4]triazine-6-carboxamide

Systemtic Name: 4-azanyl-5-[3-fluoranyl-4-[[6-(phenylcarbonyl)-1H-benzimidazol-2-yl]amino]phenyl]-N-[2,2,2-tris(fluoranyl)ethyl]pyrrolo[2,1-f][1,2,4]triazine-6-carboxamide Openeye Name: 4-amino-5-[4-[(6-benzoyl-1H-benzimidazol-2-yl)amino]-3-fluoro-phenyl]-N-(2,2,2-trifluoroethyl)pyrrolo[2,1-f][1,2,4]triazine-6-carboxamide CAS Name: 4-amino-5-[4-[(6-benzoyl-1H-benzimidazol-2-yl)amino]-3-fluorophenyl]-N-(2,2,2-trifluoroethyl)-6-pyrrolo[2,1-f][1,2,4]triazinecarboxamide IUPAC Name: 4-amino-5-[4-[(6-benzoyl-1H-benzimidazol-2-yl)amino]-3-fluorophenyl]-N-(2,2,2-trifluoroethyl)pyrrolo[2,1-f][1,2,4]triazine-6-carboxamide Traditional Name: 4-amino-5-[4-[(6-benzoyl-1H-benzimidazol-2-yl)amino]-3-fluoro-phenyl]-N-(2,2,2-trifluoroethyl)pyrrolo[2,1-f][1,2,4]triazine-6-carboxamide Formula: C29H20F4N8O2 MolecularWeight: 588.515113

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2)N=C(N3)NC4=C(C=C(C=C4)C5=C6C(=NC=NN6C=C5C(=O)NCC(F)(F)F)N)F

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2)N=C(N3)NC4=C(C=C(C=C4)C5=C6C(=NC=NN6C=C5C(=O)NCC(F)(F)F)N)F

InChI

InChI=1S/C29H20F4N8O2/c30-19-10-16(23-18(27(43)35-13-29(31,32)33)12-41-24(23)26(34)36-14-37-41)6-8-20(19)38-28-39-21-9-7-17(11-22(21)40-28)25(42)15-4-2-1-3-5-15/h1-12,14H,13H2,(H,35,43)(H2,34,36,37)(H2,38,39,40)