N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]-3-(1-phenylpyrazol-4-yl)propanamide

Systemtic Name: N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]-3-(1-phenylpyrazol-4-yl)propanamide Openeye Name: N-[4-(3-oxopiperazin-1-yl)phenyl]-3-(1-phenylpyrazol-4-yl)propanamide CAS Name: N-[4-(3-oxo-1-piperazinyl)phenyl]-3-(1-phenyl-4-pyrazolyl)propanamide IUPAC Name: N-[4-(3-oxopiperazin-1-yl)phenyl]-3-(1-phenylpyrazol-4-yl)propanamide Traditional Name: N-[4-(3-ketopiperazino)phenyl]-3-(1-phenylpyrazol-4-yl)propionamide Formula: C22H23N5O2 MolecularWeight: 389.45032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=CC=C(C=C2)NC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC(=O)N1)C2=CC=C(C=C2)NC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N5O2/c28-21(11-6-17-14-24-27(15-17)20-4-2-1-3-5-20)25-18-7-9-19(10-8-18)26-13-12-23-22(29)16-26/h1-5,7-10,14-15H,6,11-13,16H2,(H,23,29)(H,25,28)