N-ethyl-2-(4-methylsulfonylphenyl)-N-[1-(3-phenyl-1-piperazin-2-yl-propyl)piperidin-4-yl]ethanamide

Systemtic Name: N-ethyl-2-(4-methylsulfonylphenyl)-N-[1-(3-phenyl-1-piperazin-2-yl-propyl)piperidin-4-yl]ethanamide Openeye Name: N-ethyl-2-(4-methylsulfonylphenyl)-N-[1-(3-phenyl-1-piperazin-2-yl-propyl)-4-piperidyl]acetamide CAS Name: N-ethyl-2-(4-methylsulfonylphenyl)-N-[1-[3-phenyl-1-(2-piperazinyl)propyl]-4-piperidinyl]acetamide IUPAC Name: N-ethyl-2-(4-methylsulfonylphenyl)-N-[1-(3-phenyl-1-piperazin-2-ylpropyl)piperidin-4-yl]acetamide Traditional Name: N-ethyl-2-(4-mesylphenyl)-N-[1-(3-phenyl-1-piperazin-2-yl-propyl)-4-piperidyl]acetamide Formula: C29H42N4O3S MolecularWeight: 526.73378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCN(CC1)C(CCC2=CC=CC=C2)C3CNCCN3)C(=O)CC4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CCN(C1CCN(CC1)C(CCC2=CC=CC=C2)C3CNCCN3)C(=O)CC4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C29H42N4O3S/c1-3-33(29(34)21-24-9-12-26(13-10-24)37(2,35)36)25-15-19-32(20-16-25)28(27-22-30-17-18-31-27)14-11-23-7-5-4-6-8-23/h4-10,12-13,25,27-28,30-31H,3,11,14-22H2,1-2H3