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

Systemtic Name: N-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-3-(2-fluorophenyl)propanamide Openeye Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-3-(2-fluorophenyl)propanamide CAS Name: N-[3-(5-amino-4-cyano-1-phenyl-3-pyrazolyl)propyl]-3-(2-fluorophenyl)propanamide IUPAC Name: N-[3-(5-amino-4-cyano-1-phenylpyrazol-3-yl)propyl]-3-(2-fluorophenyl)propanamide Traditional Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-3-(2-fluorophenyl)propionamide Formula: C22H22FN5O MolecularWeight: 391.441383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C(=N2)CCCNC(=O)CCC3=CC=CC=C3F)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C(=N2)CCCNC(=O)CCC3=CC=CC=C3F)C#N)N

InChI

InChI=1S/C22H22FN5O/c23-19-10-5-4-7-16(19)12-13-21(29)26-14-6-11-20-18(15-24)22(25)28(27-20)17-8-2-1-3-9-17/h1-5,7-10H,6,11-14,25H2,(H,26,29)