4-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-[2-(phenylmethyl)butyl]benzamide

Systemtic Name: 4-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-[2-(phenylmethyl)butyl]benzamide Openeye Name: N-(2-benzylbutyl)-4-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide CAS Name: 4-[(4-ethylsulfonyl-1-piperazinyl)methyl]-N-[2-(phenylmethyl)butyl]benzamide IUPAC Name: N-(2-benzylbutyl)-4-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide Traditional Name: N-(2-benzylbutyl)-4-[(4-esylpiperazino)methyl]benzamide Formula: C25H35N3O3S MolecularWeight: 457.6287

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)CNC(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)CC

Isomeric SMILES

CCC(CC1=CC=CC=C1)CNC(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)CC

InChI

InChI=1S/C25H35N3O3S/c1-3-21(18-22-8-6-5-7-9-22)19-26-25(29)24-12-10-23(11-13-24)20-27-14-16-28(17-15-27)32(30,31)4-2/h5-13,21H,3-4,14-20H2,1-2H3,(H,26,29)