3-[2-[4-[(3-fluorophenyl)methyl-(1H-indazol-5-yl)amino]quinazolin-6-yl]ethynyl]piperidin-3-ol

Systemtic Name: 3-[2-[4-[(3-fluorophenyl)methyl-(1H-indazol-5-yl)amino]quinazolin-6-yl]ethynyl]piperidin-3-ol Openeye Name: 3-[2-[4-[(3-fluorophenyl)methyl-(1H-indazol-5-yl)amino]quinazolin-6-yl]ethynyl]piperidin-3-ol CAS Name: 3-[2-[4-[(3-fluorophenyl)methyl-(1H-indazol-5-yl)amino]-6-quinazolinyl]ethynyl]-3-piperidinol IUPAC Name: 3-[2-[4-[(3-fluorophenyl)methyl-(1H-indazol-5-yl)amino]quinazolin-6-yl]ethynyl]piperidin-3-ol Traditional Name: 3-[2-[4-[(3-fluorobenzyl)-(1H-indazol-5-yl)amino]quinazolin-6-yl]ethynyl]piperidin-3-ol Formula: C29H25FN6O MolecularWeight: 492.546803

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)(C#CC2=CC3=C(C=C2)N=CN=C3N(CC4=CC(=CC=C4)F)C5=CC6=C(C=C5)NN=C6)O

Isomeric SMILES

C1CC(CNC1)(C#CC2=CC3=C(C=C2)N=CN=C3N(CC4=CC(=CC=C4)F)C5=CC6=C(C=C5)NN=C6)O

InChI

InChI=1S/C29H25FN6O/c30-23-4-1-3-21(13-23)17-36(24-6-8-26-22(15-24)16-34-35-26)28-25-14-20(5-7-27(25)32-19-33-28)9-11-29(37)10-2-12-31-18-29/h1,3-8,13-16,19,31,37H,2,10,12,17-18H2,(H,34,35)