N-[2-[1-[[4-[[1-[(3-fluorophenyl)methyl]indazol-5-yl]amino]pyrrolo[2,1-f][1,2,4]triazin-5-yl]methyl]imidazol-4-yl]ethyl]ethanamide

Systemtic Name: N-[2-[1-[[4-[[1-[(3-fluorophenyl)methyl]indazol-5-yl]amino]pyrrolo[2,1-f][1,2,4]triazin-5-yl]methyl]imidazol-4-yl]ethyl]ethanamide Openeye Name: N-[2-[1-[[4-[[1-[(3-fluorophenyl)methyl]indazol-5-yl]amino]pyrrolo[2,1-f][1,2,4]triazin-5-yl]methyl]imidazol-4-yl]ethyl]acetamide CAS Name: N-[2-[1-[[4-[[1-[(3-fluorophenyl)methyl]-5-indazolyl]amino]-5-pyrrolo[2,1-f][1,2,4]triazinyl]methyl]-4-imidazolyl]ethyl]acetamide IUPAC Name: N-[2-[1-[[4-[[1-[(3-fluorophenyl)methyl]indazol-5-yl]amino]pyrrolo[2,1-f][1,2,4]triazin-5-yl]methyl]imidazol-4-yl]ethyl]acetamide Traditional Name: N-[2-[1-[[4-[[1-(3-fluorobenzyl)indazol-5-yl]amino]pyrrolo[2,1-f][1,2,4]triazin-5-yl]methyl]imidazol-4-yl]ethyl]acetamide Formula: C28H26FN9O MolecularWeight: 523.564143

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC1=CN(C=N1)CC2=C3C(=NC=NN3C=C2)NC4=CC5=C(C=C4)N(N=C5)CC6=CC(=CC=C6)F

Isomeric SMILES

CC(=O)NCCC1=CN(C=N1)CC2=C3C(=NC=NN3C=C2)NC4=CC5=C(C=C4)N(N=C5)CC6=CC(=CC=C6)F

InChI

InChI=1S/C28H26FN9O/c1-19(39)30-9-7-25-16-36(18-32-25)15-21-8-10-37-27(21)28(31-17-34-37)35-24-5-6-26-22(12-24)13-33-38(26)14-20-3-2-4-23(29)11-20/h2-6,8,10-13,16-18H,7,9,14-15H2,1H3,(H,30,39)(H,31,34,35)