1-phenyl-1-[4-(3-phenylsulfanylpropyl)piperazin-1-yl]pentan-2-one dihydrochloride

Systemtic Name: 1-phenyl-1-[4-(3-phenylsulfanylpropyl)piperazin-1-yl]pentan-2-one dihydrochloride Openeye Name: 1-phenyl-1-[4-(3-phenylsulfanylpropyl)piperazin-1-yl]pentan-2-one dihydrochloride CAS Name: 1-phenyl-1-[4-[3-(phenylthio)propyl]-1-piperazinyl]-2-pentanone dihydrochloride IUPAC Name: 1-phenyl-1-[4-(3-phenylsulfanylpropyl)piperazin-1-yl]pentan-2-one dihydrochloride Traditional Name: 1-phenyl-1-[4-[3-(phenylthio)propyl]piperazino]pentan-2-one dihydrochloride Formula: C24H34Cl2N2OS MolecularWeight: 469.51056

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(C1=CC=CC=C1)N2CCN(CC2)CCCSC3=CC=CC=C3.Cl.Cl

Isomeric SMILES

CCCC(=O)C(C1=CC=CC=C1)N2CCN(CC2)CCCSC3=CC=CC=C3.Cl.Cl

InChI

InChI=1S/C24H32N2OS.2ClH/c1-2-10-23(27)24(21-11-5-3-6-12-21)26-18-16-25(17-19-26)15-9-20-28-22-13-7-4-8-14-22;;/h3-8,11-14,24H,2,9-10,15-20H2,1H3;2*1H