2-[2-[4-(2-phenylsulfanylethyl)piperazin-1-yl]carbonylphenyl]sulfanyl-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[2-[4-(2-phenylsulfanylethyl)piperazin-1-yl]carbonylphenyl]sulfanyl-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[2-[4-(2-phenylsulfanylethyl)piperazine-1-carbonyl]phenyl]sulfanyl-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[[2-[oxo-[4-[2-(phenylthio)ethyl]-1-piperazinyl]methyl]phenyl]thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[2-[4-(2-phenylsulfanylethyl)piperazine-1-carbonyl]phenyl]sulfanyl-1-pyrrolidin-1-ylethanone Traditional Name: 2-[[2-[4-[2-(phenylthio)ethyl]piperazine-1-carbonyl]phenyl]thio]-1-pyrrolidino-ethanone Formula: C25H31N3O2S2 MolecularWeight: 469.66254

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=CC=CC=C2C(=O)N3CCN(CC3)CCSC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=CC=CC=C2C(=O)N3CCN(CC3)CCSC4=CC=CC=C4

InChI

InChI=1S/C25H31N3O2S2/c29-24(27-12-6-7-13-27)20-32-23-11-5-4-10-22(23)25(30)28-16-14-26(15-17-28)18-19-31-21-8-2-1-3-9-21/h1-5,8-11H,6-7,12-20H2