N-[4-[3-[4-(phenylmethyl)piperazin-1-yl]propylsulfonyl]phenyl]ethanamide

Systemtic Name: N-[4-[3-[4-(phenylmethyl)piperazin-1-yl]propylsulfonyl]phenyl]ethanamide Openeye Name: N-[4-[3-(4-benzylpiperazin-1-yl)propylsulfonyl]phenyl]acetamide CAS Name: N-[4-[3-[4-(phenylmethyl)-1-piperazinyl]propylsulfonyl]phenyl]acetamide IUPAC Name: N-[4-[3-(4-benzylpiperazin-1-yl)propylsulfonyl]phenyl]acetamide Traditional Name: N-[4-[3-(4-benzylpiperazino)propylsulfonyl]phenyl]acetamide Formula: C22H29N3O3S MolecularWeight: 415.54896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)CCCN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)CCCN2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H29N3O3S/c1-19(26)23-21-8-10-22(11-9-21)29(27,28)17-5-12-24-13-15-25(16-14-24)18-20-6-3-2-4-7-20/h2-4,6-11H,5,12-18H2,1H3,(H,23,26)