N-[2-[4-(2-ethylsulfanylphenyl)carbonylpiperazin-1-yl]ethyl]-4-fluoranyl-benzamide

Systemtic Name: N-[2-[4-(2-ethylsulfanylphenyl)carbonylpiperazin-1-yl]ethyl]-4-fluoranyl-benzamide Openeye Name: N-[2-[4-(2-ethylsulfanylbenzoyl)piperazin-1-yl]ethyl]-4-fluoro-benzamide CAS Name: N-[2-[4-[[2-(ethylthio)phenyl]-oxomethyl]-1-piperazinyl]ethyl]-4-fluorobenzamide IUPAC Name: N-[2-[4-(2-ethylsulfanylbenzoyl)piperazin-1-yl]ethyl]-4-fluorobenzamide Traditional Name: N-[2-[4-[2-(ethylthio)benzoyl]piperazino]ethyl]-4-fluoro-benzamide Formula: C22H26FN3O2S MolecularWeight: 415.524143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)N2CCN(CC2)CCNC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)N2CCN(CC2)CCNC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H26FN3O2S/c1-2-29-20-6-4-3-5-19(20)22(28)26-15-13-25(14-16-26)12-11-24-21(27)17-7-9-18(23)10-8-17/h3-10H,2,11-16H2,1H3,(H,24,27)