4-chloranyl-N-[4-methyl-1-oxidanylidene-1-(4-pyrimidin-2-ylpiperazin-1-yl)pentan-2-yl]benzamide

Systemtic Name: 4-chloranyl-N-[4-methyl-1-oxidanylidene-1-(4-pyrimidin-2-ylpiperazin-1-yl)pentan-2-yl]benzamide Openeye Name: 4-chloro-N-[3-methyl-1-(4-pyrimidin-2-ylpiperazine-1-carbonyl)butyl]benzamide CAS Name: 4-chloro-N-[4-methyl-1-oxo-1-[4-(2-pyrimidinyl)-1-piperazinyl]pentan-2-yl]benzamide IUPAC Name: 4-chloro-N-[4-methyl-1-oxo-1-(4-pyrimidin-2-ylpiperazin-1-yl)pentan-2-yl]benzamide Traditional Name: 4-chloro-N-[3-methyl-1-[4-(2-pyrimidyl)piperazine-1-carbonyl]butyl]benzamide Formula: C21H26ClN5O2 MolecularWeight: 415.91644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCN(CC1)C2=NC=CC=N2)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)CC(C(=O)N1CCN(CC1)C2=NC=CC=N2)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H26ClN5O2/c1-15(2)14-18(25-19(28)16-4-6-17(22)7-5-16)20(29)26-10-12-27(13-11-26)21-23-8-3-9-24-21/h3-9,15,18H,10-14H2,1-2H3,(H,25,28)