N-(2-phenylsulfanylethyl)-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: N-(2-phenylsulfanylethyl)-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide Openeye Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(2-phenylsulfanylethyl)benzamide CAS Name: 3-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-[2-(phenylthio)ethyl]benzamide IUPAC Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(2-phenylsulfanylethyl)benzamide Traditional Name: 3-[(4-besylpiperazino)methyl]-N-[2-(phenylthio)ethyl]benzamide Formula: C26H29N3O3S2 MolecularWeight: 495.65676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC(=C2)C(=O)NCCSC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC(=C2)C(=O)NCCSC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H29N3O3S2/c30-26(27-14-19-33-24-10-3-1-4-11-24)23-9-7-8-22(20-23)21-28-15-17-29(18-16-28)34(31,32)25-12-5-2-6-13-25/h1-13,20H,14-19,21H2,(H,27,30)