2-[3-[1-(3-fluoranyl-4-phenyl-phenyl)ethyl]-1,2-oxazol-5-yl]-1-pyrimidin-2-yl-guanidine

Systemtic Name: 2-[3-[1-(3-fluoranyl-4-phenyl-phenyl)ethyl]-1,2-oxazol-5-yl]-1-pyrimidin-2-yl-guanidine Openeye Name: 2-[3-[1-(3-fluoro-4-phenyl-phenyl)ethyl]isoxazol-5-yl]-1-pyrimidin-2-yl-guanidine CAS Name: 2-[3-[1-(3-fluoro-4-phenylphenyl)ethyl]-5-isoxazolyl]-1-(2-pyrimidinyl)guanidine IUPAC Name: 2-[3-[1-(3-fluoro-4-phenylphenyl)ethyl]-1,2-oxazol-5-yl]-1-pyrimidin-2-ylguanidine Traditional Name: 2-[3-[1-(3-fluoro-4-phenyl-phenyl)ethyl]isoxazol-5-yl]-1-(2-pyrimidyl)guanidine Formula: C22H19FN6O MolecularWeight: 402.424263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C3=NOC(=C3)N=C(N)NC4=NC=CC=N4

Isomeric SMILES

CC(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C3=NOC(=C3)/N=C(/N)\NC4=NC=CC=N4

InChI

InChI=1S/C22H19FN6O/c1-14(16-8-9-17(18(23)12-16)15-6-3-2-4-7-15)19-13-20(30-29-19)27-21(24)28-22-25-10-5-11-26-22/h2-14H,1H3,(H3,24,25,26,27,28)