2-(3-chloranyl-4-fluoranyl-phenyl)sulfanyl-1-[4-(4-hydroxyphenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(3-chloranyl-4-fluoranyl-phenyl)sulfanyl-1-[4-(4-hydroxyphenyl)piperazin-1-yl]ethanone Openeye Name: 2-(3-chloro-4-fluoro-phenyl)sulfanyl-1-[4-(4-hydroxyphenyl)piperazin-1-yl]ethanone CAS Name: 2-[(3-chloro-4-fluorophenyl)thio]-1-[4-(4-hydroxyphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(3-chloro-4-fluorophenyl)sulfanyl-1-[4-(4-hydroxyphenyl)piperazin-1-yl]ethanone Traditional Name: 2-[(3-chloro-4-fluoro-phenyl)thio]-1-[4-(4-hydroxyphenyl)piperazino]ethanone Formula: C18H18ClFN2O2S MolecularWeight: 380.864123

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)O)C(=O)CSC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)O)C(=O)CSC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C18H18ClFN2O2S/c19-16-11-15(5-6-17(16)20)25-12-18(24)22-9-7-21(8-10-22)13-1-3-14(23)4-2-13/h1-6,11,23H,7-10,12H2