3-(methylsulfinylmethyl)-N-[3-(4-phenylpiperazin-1-yl)propyl]benzamide

Systemtic Name: 3-(methylsulfinylmethyl)-N-[3-(4-phenylpiperazin-1-yl)propyl]benzamide Openeye Name: 3-(methylsulfinylmethyl)-N-[3-(4-phenylpiperazin-1-yl)propyl]benzamide CAS Name: 3-(methylsulfinylmethyl)-N-[3-(4-phenyl-1-piperazinyl)propyl]benzamide IUPAC Name: 3-(methylsulfinylmethyl)-N-[3-(4-phenylpiperazin-1-yl)propyl]benzamide Traditional Name: 3-(methylsulfinylmethyl)-N-[3-(4-phenylpiperazino)propyl]benzamide Formula: C22H29N3O2S MolecularWeight: 399.54956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)CC1=CC=CC(=C1)C(=O)NCCCN2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CS(=O)CC1=CC=CC(=C1)C(=O)NCCCN2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C22H29N3O2S/c1-28(27)18-19-7-5-8-20(17-19)22(26)23-11-6-12-24-13-15-25(16-14-24)21-9-3-2-4-10-21/h2-5,7-10,17H,6,11-16,18H2,1H3,(H,23,26)