1-(4-bromanyl-2-propyl-phenyl)-3-methylsulfanyl-piperazine

Systemtic Name: 1-(4-bromanyl-2-propyl-phenyl)-3-methylsulfanyl-piperazine Openeye Name: 1-(4-bromo-2-propyl-phenyl)-3-methylsulfanyl-piperazine CAS Name: 1-(4-bromo-2-propylphenyl)-3-(methylthio)piperazine IUPAC Name: 1-(4-bromo-2-propylphenyl)-3-methylsulfanylpiperazine Traditional Name: 1-(4-bromo-2-propyl-phenyl)-3-(methylthio)piperazine Formula: C14H21BrN2S MolecularWeight: 329.29894

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)Br)N2CCNC(C2)SC

Isomeric SMILES

CCCC1=C(C=CC(=C1)Br)N2CCNC(C2)SC

InChI

InChI=1S/C14H21BrN2S/c1-3-4-11-9-12(15)5-6-13(11)17-8-7-16-14(10-17)18-2/h5-6,9,14,16H,3-4,7-8,10H2,1-2H3