4-butoxy-3-chloranyl-5-ethoxy-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide

Systemtic Name: 4-butoxy-3-chloranyl-5-ethoxy-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide Openeye Name: 4-butoxy-3-chloro-5-ethoxy-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide CAS Name: 4-butoxy-3-chloro-5-ethoxy-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]benzamide IUPAC Name: 4-butoxy-3-chloro-5-ethoxy-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide Traditional Name: 4-butoxy-3-chloro-5-ethoxy-N-[3-[4-(2-pyrimidyl)piperazino]propyl]benzamide Formula: C24H34ClN5O3 MolecularWeight: 476.01146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Cl)C(=O)NCCCN2CCN(CC2)C3=NC=CC=N3)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)C(=O)NCCCN2CCN(CC2)C3=NC=CC=N3)OCC

InChI

InChI=1S/C24H34ClN5O3/c1-3-5-16-33-22-20(25)17-19(18-21(22)32-4-2)23(31)26-10-7-11-29-12-14-30(15-13-29)24-27-8-6-9-28-24/h6,8-9,17-18H,3-5,7,10-16H2,1-2H3,(H,26,31)