N-(3-chlorophenyl)-1-ethanoyl-N-[3-[4-(1-methylimidazol-2-yl)sulfanylpiperidin-1-yl]propyl]piperidine-4-carboxamide

Systemtic Name: N-(3-chlorophenyl)-1-ethanoyl-N-[3-[4-(1-methylimidazol-2-yl)sulfanylpiperidin-1-yl]propyl]piperidine-4-carboxamide Openeye Name: 1-acetyl-N-(3-chlorophenyl)-N-[3-[4-(1-methylimidazol-2-yl)sulfanyl-1-piperidyl]propyl]piperidine-4-carboxamide CAS Name: 1-acetyl-N-(3-chlorophenyl)-N-[3-[4-[(1-methyl-2-imidazolyl)thio]-1-piperidinyl]propyl]-4-piperidinecarboxamide IUPAC Name: 1-acetyl-N-(3-chlorophenyl)-N-[3-[4-(1-methylimidazol-2-yl)sulfanylpiperidin-1-yl]propyl]piperidine-4-carboxamide Traditional Name: 1-acetyl-N-(3-chlorophenyl)-N-[3-[4-[(1-methylimidazol-2-yl)thio]piperidino]propyl]isonipecotamide Formula: C26H36ClN5O2S MolecularWeight: 518.11434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)C(=O)N(CCCN2CCC(CC2)SC3=NC=CN3C)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC(=O)N1CCC(CC1)C(=O)N(CCCN2CCC(CC2)SC3=NC=CN3C)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C26H36ClN5O2S/c1-20(33)31-16-7-21(8-17-31)25(34)32(23-6-3-5-22(27)19-23)13-4-12-30-14-9-24(10-15-30)35-26-28-11-18-29(26)2/h3,5-6,11,18-19,21,24H,4,7-10,12-17H2,1-2H3