N,N-diethyl-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanoylamino]benzamide

Systemtic Name: N,N-diethyl-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanoylamino]benzamide Openeye Name: N,N-diethyl-3-[[2-(4-pyrimidin-2-ylpiperazin-1-yl)acetyl]amino]benzamide CAS Name: N,N-diethyl-3-[[1-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]amino]benzamide IUPAC Name: N,N-diethyl-3-[[2-(4-pyrimidin-2-ylpiperazin-1-yl)acetyl]amino]benzamide Traditional Name: N,N-diethyl-3-[[2-[4-(2-pyrimidyl)piperazino]acetyl]amino]benzamide Formula: C21H28N6O2 MolecularWeight: 396.48602

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CN2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CN2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C21H28N6O2/c1-3-26(4-2)20(29)17-7-5-8-18(15-17)24-19(28)16-25-11-13-27(14-12-25)21-22-9-6-10-23-21/h5-10,15H,3-4,11-14,16H2,1-2H3,(H,24,28)