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

Systemtic Name: 2-[2-[4-(2-chlorophenyl)piperazin-1-yl]carbonylphenyl]sulfanyl-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[2-[4-(2-chlorophenyl)piperazine-1-carbonyl]phenyl]sulfanyl-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[[2-[[4-(2-chlorophenyl)-1-piperazinyl]-oxomethyl]phenyl]thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[2-[4-(2-chlorophenyl)piperazine-1-carbonyl]phenyl]sulfanyl-1-pyrrolidin-1-ylethanone Traditional Name: 2-[[2-[4-(2-chlorophenyl)piperazine-1-carbonyl]phenyl]thio]-1-pyrrolidino-ethanone Formula: C23H26ClN3O2S MolecularWeight: 443.98944

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=CC=CC=C2C(=O)N3CCN(CC3)C4=CC=CC=C4Cl

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=CC=CC=C2C(=O)N3CCN(CC3)C4=CC=CC=C4Cl

InChI

InChI=1S/C23H26ClN3O2S/c24-19-8-2-3-9-20(19)25-13-15-27(16-14-25)23(29)18-7-1-4-10-21(18)30-17-22(28)26-11-5-6-12-26/h1-4,7-10H,5-6,11-17H2