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

Systemtic Name: N-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-(4-chloranylphenoxy)ethanamide Openeye Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-(4-chlorophenoxy)acetamide CAS Name: N-[3-(5-amino-4-cyano-1-phenyl-3-pyrazolyl)propyl]-2-(4-chlorophenoxy)acetamide IUPAC Name: N-[3-(5-amino-4-cyano-1-phenylpyrazol-3-yl)propyl]-2-(4-chlorophenoxy)acetamide Traditional Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-(4-chlorophenoxy)acetamide Formula: C21H20ClN5O2 MolecularWeight: 409.8688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C(=N2)CCCNC(=O)COC3=CC=C(C=C3)Cl)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C(=N2)CCCNC(=O)COC3=CC=C(C=C3)Cl)C#N)N

InChI

InChI=1S/C21H20ClN5O2/c22-15-8-10-17(11-9-15)29-14-20(28)25-12-4-7-19-18(13-23)21(24)27(26-19)16-5-2-1-3-6-16/h1-3,5-6,8-11H,4,7,12,14,24H2,(H,25,28)