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

Systemtic Name: N-[3-[5-azanyl-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-2-(2-phenoxyethoxy)benzamide Openeye Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-2-(2-phenoxyethoxy)benzamide CAS Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)-3-pyrazolyl]propyl]-2-(2-phenoxyethoxy)benzamide IUPAC Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-2-(2-phenoxyethoxy)benzamide Traditional Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-2-(2-phenoxyethoxy)benzamide Formula: C28H26FN5O3 MolecularWeight: 499.536143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCOC2=CC=CC=C2C(=O)NCCCC3=NN(C(=C3C#N)N)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)OCCOC2=CC=CC=C2C(=O)NCCCC3=NN(C(=C3C#N)N)C4=CC=C(C=C4)F

InChI

InChI=1S/C28H26FN5O3/c29-20-12-14-21(15-13-20)34-27(31)24(19-30)25(33-34)10-6-16-32-28(35)23-9-4-5-11-26(23)37-18-17-36-22-7-2-1-3-8-22/h1-5,7-9,11-15H,6,10,16-18,31H2,(H,32,35)