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

Systemtic Name: N-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-(2-chloranylphenoxy)propanamide Openeye Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-(2-chlorophenoxy)propanamide CAS Name: N-[3-(5-amino-4-cyano-1-phenyl-3-pyrazolyl)propyl]-2-(2-chlorophenoxy)propanamide IUPAC Name: N-[3-(5-amino-4-cyano-1-phenylpyrazol-3-yl)propyl]-2-(2-chlorophenoxy)propanamide Traditional Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-(2-chlorophenoxy)propionamide Formula: C22H22ClN5O2 MolecularWeight: 423.89538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCCC1=NN(C(=C1C#N)N)C2=CC=CC=C2)OC3=CC=CC=C3Cl

Isomeric SMILES

CC(C(=O)NCCCC1=NN(C(=C1C#N)N)C2=CC=CC=C2)OC3=CC=CC=C3Cl

InChI

InChI=1S/C22H22ClN5O2/c1-15(30-20-12-6-5-10-18(20)23)22(29)26-13-7-11-19-17(14-24)21(25)28(27-19)16-8-3-2-4-9-16/h2-6,8-10,12,15H,7,11,13,25H2,1H3,(H,26,29)