N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide

Systemtic Name: N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide Openeye Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide CAS Name: N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]-4-(1-pyrazolylmethyl)benzamide IUPAC Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide Traditional Name: N-[3-chloro-4-(3-ketopiperazino)phenyl]-4-(pyrazol-1-ylmethyl)benzamide Formula: C21H20ClN5O2 MolecularWeight: 409.8688

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)CN4C=CC=N4)Cl

Isomeric SMILES

C1CN(CC(=O)N1)C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)CN4C=CC=N4)Cl

InChI

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