N-[2-(4-ethylpiperazin-1-yl)-5-piperidin-1-ylsulfonyl-phenyl]-2-(4-propanoylphenoxy)ethanamide

Systemtic Name: N-[2-(4-ethylpiperazin-1-yl)-5-piperidin-1-ylsulfonyl-phenyl]-2-(4-propanoylphenoxy)ethanamide Openeye Name: N-[2-(4-ethylpiperazin-1-yl)-5-(1-piperidylsulfonyl)phenyl]-2-(4-propanoylphenoxy)acetamide CAS Name: N-[2-(4-ethyl-1-piperazinyl)-5-(1-piperidinylsulfonyl)phenyl]-2-[4-(1-oxopropyl)phenoxy]acetamide IUPAC Name: N-[2-(4-ethylpiperazin-1-yl)-5-piperidin-1-ylsulfonylphenyl]-2-(4-propanoylphenoxy)acetamide Traditional Name: N-[2-(4-ethylpiperazino)-5-piperidinosulfonyl-phenyl]-2-(4-propionylphenoxy)acetamide Formula: C28H38N4O5S MolecularWeight: 542.69012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CCN(CC4)CC

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CCN(CC4)CC

InChI

InChI=1S/C28H38N4O5S/c1-3-27(33)22-8-10-23(11-9-22)37-21-28(34)29-25-20-24(38(35,36)32-14-6-5-7-15-32)12-13-26(25)31-18-16-30(4-2)17-19-31/h8-13,20H,3-7,14-19,21H2,1-2H3,(H,29,34)