1-[(4-methylsulfanylphenyl)methyl]-4-pentan-3-yl-piperazine

Systemtic Name: 1-[(4-methylsulfanylphenyl)methyl]-4-pentan-3-yl-piperazine Openeye Name: 1-(1-ethylpropyl)-4-[(4-methylsulfanylphenyl)methyl]piperazine CAS Name: 1-[[4-(methylthio)phenyl]methyl]-4-pentan-3-ylpiperazine IUPAC Name: 1-[(4-methylsulfanylphenyl)methyl]-4-pentan-3-ylpiperazine Traditional Name: 1-(1-ethylpropyl)-4-[4-(methylthio)benzyl]piperazine Formula: C17H28N2S MolecularWeight: 292.48262

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1CCN(CC1)CC2=CC=C(C=C2)SC

Isomeric SMILES

CCC(CC)N1CCN(CC1)CC2=CC=C(C=C2)SC

InChI

InChI=1S/C17H28N2S/c1-4-16(5-2)19-12-10-18(11-13-19)14-15-6-8-17(20-3)9-7-15/h6-9,16H,4-5,10-14H2,1-3H3