N-(phenylmethyl)-2-[4-(3-piperidin-1-ylsulfonylphenyl)carbonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(phenylmethyl)-2-[4-(3-piperidin-1-ylsulfonylphenyl)carbonylpiperazin-1-yl]ethanamide Openeye Name: N-benzyl-2-[4-[3-(1-piperidylsulfonyl)benzoyl]piperazin-1-yl]acetamide CAS Name: 2-[4-[oxo-[3-(1-piperidinylsulfonyl)phenyl]methyl]-1-piperazinyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(3-piperidin-1-ylsulfonylbenzoyl)piperazin-1-yl]acetamide Traditional Name: N-benzyl-2-[4-(3-piperidinosulfonylbenzoyl)piperazino]acetamide Formula: C25H32N4O4S MolecularWeight: 484.61098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)CC(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)CC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C25H32N4O4S/c30-24(26-19-21-8-3-1-4-9-21)20-27-14-16-28(17-15-27)25(31)22-10-7-11-23(18-22)34(32,33)29-12-5-2-6-13-29/h1,3-4,7-11,18H,2,5-6,12-17,19-20H2,(H,26,30)