4-[(4-chloranyl-6-piperidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]-N-[3-(2-methylpiperidin-1-yl)propyl]benzamide

Systemtic Name: 4-[(4-chloranyl-6-piperidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]-N-[3-(2-methylpiperidin-1-yl)propyl]benzamide Openeye Name: 4-[[4-chloro-6-(1-piperidyl)pyrimidin-2-yl]sulfanylmethyl]-N-[3-(2-methyl-1-piperidyl)propyl]benzamide CAS Name: 4-[[[4-chloro-6-(1-piperidinyl)-2-pyrimidinyl]thio]methyl]-N-[3-(2-methyl-1-piperidinyl)propyl]benzamide IUPAC Name: 4-[(4-chloro-6-piperidin-1-ylpyrimidin-2-yl)sulfanylmethyl]-N-[3-(2-methylpiperidin-1-yl)propyl]benzamide Traditional Name: 4-[[(4-chloro-6-piperidino-pyrimidin-2-yl)thio]methyl]-N-[3-(2-methylpiperidino)propyl]benzamide Formula: C26H36ClN5OS MolecularWeight: 502.11494

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCCNC(=O)C2=CC=C(C=C2)CSC3=NC(=CC(=N3)Cl)N4CCCCC4

Isomeric SMILES

CC1CCCCN1CCCNC(=O)C2=CC=C(C=C2)CSC3=NC(=CC(=N3)Cl)N4CCCCC4

InChI

InChI=1S/C26H36ClN5OS/c1-20-8-3-6-14-31(20)17-7-13-28-25(33)22-11-9-21(10-12-22)19-34-26-29-23(27)18-24(30-26)32-15-4-2-5-16-32/h9-12,18,20H,2-8,13-17,19H2,1H3,(H,28,33)