2-(4-fluoranyl-3-methyl-phenyl)sulfanyl-1-piperazin-1-yl-ethanone

Systemtic Name: 2-(4-fluoranyl-3-methyl-phenyl)sulfanyl-1-piperazin-1-yl-ethanone Openeye Name: 2-(4-fluoro-3-methyl-phenyl)sulfanyl-1-piperazin-1-yl-ethanone CAS Name: 2-[(4-fluoro-3-methylphenyl)thio]-1-(1-piperazinyl)ethanone IUPAC Name: 2-(4-fluoro-3-methylphenyl)sulfanyl-1-piperazin-1-ylethanone Traditional Name: 2-[(4-fluoro-3-methyl-phenyl)thio]-1-piperazino-ethanone Formula: C13H17FN2OS MolecularWeight: 268.350283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SCC(=O)N2CCNCC2)F

Isomeric SMILES

CC1=C(C=CC(=C1)SCC(=O)N2CCNCC2)F

InChI

InChI=1S/C13H17FN2OS/c1-10-8-11(2-3-12(10)14)18-9-13(17)16-6-4-15-5-7-16/h2-3,8,15H,4-7,9H2,1H3