2-ethylsulfanyl-N-[3-(4-phenylpiperazin-1-yl)sulfonylpropyl]benzamide

Systemtic Name: 2-ethylsulfanyl-N-[3-(4-phenylpiperazin-1-yl)sulfonylpropyl]benzamide Openeye Name: 2-ethylsulfanyl-N-[3-(4-phenylpiperazin-1-yl)sulfonylpropyl]benzamide CAS Name: 2-(ethylthio)-N-[3-[(4-phenyl-1-piperazinyl)sulfonyl]propyl]benzamide IUPAC Name: 2-ethylsulfanyl-N-[3-(4-phenylpiperazin-1-yl)sulfonylpropyl]benzamide Traditional Name: 2-(ethylthio)-N-[3-(4-phenylpiperazino)sulfonylpropyl]benzamide Formula: C22H29N3O3S2 MolecularWeight: 447.61396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)NCCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)NCCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C22H29N3O3S2/c1-2-29-21-12-7-6-11-20(21)22(26)23-13-8-18-30(27,28)25-16-14-24(15-17-25)19-9-4-3-5-10-19/h3-7,9-12H,2,8,13-18H2,1H3,(H,23,26)