1-(4-ethylsulfinylphenoxy)-3-(4-phenylpiperazin-1-yl)propan-2-ol dihydrochloride

Systemtic Name: 1-(4-ethylsulfinylphenoxy)-3-(4-phenylpiperazin-1-yl)propan-2-ol dihydrochloride Openeye Name: 1-(4-ethylsulfinylphenoxy)-3-(4-phenylpiperazin-1-yl)propan-2-ol dihydrochloride CAS Name: 1-(4-ethylsulfinylphenoxy)-3-(4-phenyl-1-piperazinyl)-2-propanol dihydrochloride IUPAC Name: 1-(4-ethylsulfinylphenoxy)-3-(4-phenylpiperazin-1-yl)propan-2-ol dihydrochloride Traditional Name: 1-(4-ethylsulfinylphenoxy)-3-(4-phenylpiperazino)propan-2-ol dihydrochloride Formula: C21H30Cl2N2O3S MolecularWeight: 461.4455

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)C3=CC=CC=C3)O.Cl.Cl

Isomeric SMILES

CCS(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)C3=CC=CC=C3)O.Cl.Cl

InChI

InChI=1S/C21H28N2O3S.2ClH/c1-2-27(25)21-10-8-20(9-11-21)26-17-19(24)16-22-12-14-23(15-13-22)18-6-4-3-5-7-18;;/h3-11,19,24H,2,12-17H2,1H3;2*1H