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

Systemtic Name: 2-chloranyl-5-methylsulfanyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide Openeye Name: 2-chloro-5-methylsulfanyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide CAS Name: 2-chloro-5-(methylthio)-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]benzamide IUPAC Name: 2-chloro-5-methylsulfanyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide Traditional Name: 2-chloro-5-(methylthio)-N-[3-[4-(2-pyrimidyl)piperazino]propyl]benzamide Formula: C19H24ClN5OS MolecularWeight: 405.94476

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)Cl)C(=O)NCCCN2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CSC1=CC(=C(C=C1)Cl)C(=O)NCCCN2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C19H24ClN5OS/c1-27-15-4-5-17(20)16(14-15)18(26)21-8-3-9-24-10-12-25(13-11-24)19-22-6-2-7-23-19/h2,4-7,14H,3,8-13H2,1H3,(H,21,26)