(2S)-2-azanyl-1-[4-(4-fluorophenyl)piperazin-1-yl]-4-methylsulfanyl-butan-1-one

Systemtic Name: (2S)-2-azanyl-1-[4-(4-fluorophenyl)piperazin-1-yl]-4-methylsulfanyl-butan-1-one Openeye Name: (2S)-2-amino-1-[4-(4-fluorophenyl)piperazin-1-yl]-4-methylsulfanyl-butan-1-one CAS Name: (2S)-2-amino-1-[4-(4-fluorophenyl)-1-piperazinyl]-4-(methylthio)-1-butanone IUPAC Name: (2S)-2-amino-1-[4-(4-fluorophenyl)piperazin-1-yl]-4-methylsulfanylbutan-1-one Traditional Name: (2S)-2-amino-1-[4-(4-fluorophenyl)piperazino]-4-(methylthio)butan-1-one Formula: C15H22FN3OS MolecularWeight: 311.418083

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCN(CC1)C2=CC=C(C=C2)F)N

Isomeric SMILES

CSCC[C@@H](C(=O)N1CCN(CC1)C2=CC=C(C=C2)F)N

InChI

InChI=1S/C15H22FN3OS/c1-21-11-6-14(17)15(20)19-9-7-18(8-10-19)13-4-2-12(16)3-5-13/h2-5,14H,6-11,17H2,1H3/t14-/m0/s1