4-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-[3-(2-propoxyphenyl)propyl]benzamide

Systemtic Name: 4-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-[3-(2-propoxyphenyl)propyl]benzamide Openeye Name: 4-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-[3-(2-propoxyphenyl)propyl]benzamide CAS Name: 4-[(4-ethylsulfonyl-1-piperazinyl)methyl]-N-[3-(2-propoxyphenyl)propyl]benzamide IUPAC Name: 4-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-[3-(2-propoxyphenyl)propyl]benzamide Traditional Name: 4-[(4-esylpiperazino)methyl]-N-[3-(2-propoxyphenyl)propyl]benzamide Formula: C26H37N3O4S MolecularWeight: 487.65468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1CCCNC(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)CC

Isomeric SMILES

CCCOC1=CC=CC=C1CCCNC(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)CC

InChI

InChI=1S/C26H37N3O4S/c1-3-20-33-25-10-6-5-8-23(25)9-7-15-27-26(30)24-13-11-22(12-14-24)21-28-16-18-29(19-17-28)34(31,32)4-2/h5-6,8,10-14H,3-4,7,9,15-21H2,1-2H3,(H,27,30)