N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-4-(pyrazol-1-ylmethyl)benzamide

Systemtic Name: N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-4-(pyrazol-1-ylmethyl)benzamide Openeye Name: N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]-4-(pyrazol-1-ylmethyl)benzamide CAS Name: N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-4-(1-pyrazolylmethyl)benzamide IUPAC Name: N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]-4-(pyrazol-1-ylmethyl)benzamide Traditional Name: N-[6-(3-ketopiperazino)-3-pyridyl]-4-(pyrazol-1-ylmethyl)benzamide Formula: C20H20N6O2 MolecularWeight: 376.4118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N6O2/c27-19-14-25(11-9-21-19)18-7-6-17(12-22-18)24-20(28)16-4-2-15(3-5-16)13-26-10-1-8-23-26/h1-8,10,12H,9,11,13-14H2,(H,21,27)(H,24,28)