N-[3-[5-azanyl-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-2-(4-phenoxyphenoxy)ethanamide

Systemtic Name: N-[3-[5-azanyl-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-2-(4-phenoxyphenoxy)ethanamide Openeye Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-2-(4-phenoxyphenoxy)acetamide CAS Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)-3-pyrazolyl]propyl]-2-(4-phenoxyphenoxy)acetamide IUPAC Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-2-(4-phenoxyphenoxy)acetamide Traditional Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-2-(4-phenoxyphenoxy)acetamide Formula: C27H24FN5O3 MolecularWeight: 485.509563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)OCC(=O)NCCCC3=NN(C(=C3C#N)N)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)OCC(=O)NCCCC3=NN(C(=C3C#N)N)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H24FN5O3/c28-19-8-10-20(11-9-19)33-27(30)24(17-29)25(32-33)7-4-16-31-26(34)18-35-21-12-14-23(15-13-21)36-22-5-2-1-3-6-22/h1-3,5-6,8-15H,4,7,16,18,30H2,(H,31,34)