1-[1-[(4-methylsulfanylphenyl)methyl]piperidin-4-yl]azepane

Systemtic Name: 1-[1-[(4-methylsulfanylphenyl)methyl]piperidin-4-yl]azepane Openeye Name: 1-[1-[(4-methylsulfanylphenyl)methyl]-4-piperidyl]azepane CAS Name: 1-[1-[[4-(methylthio)phenyl]methyl]-4-piperidinyl]azepane IUPAC Name: 1-[1-[(4-methylsulfanylphenyl)methyl]piperidin-4-yl]azepane Traditional Name: 1-[1-[4-(methylthio)benzyl]-4-piperidyl]azepane Formula: C19H30N2S MolecularWeight: 318.5199

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CN2CCC(CC2)N3CCCCCC3

Isomeric SMILES

CSC1=CC=C(C=C1)CN2CCC(CC2)N3CCCCCC3

InChI

InChI=1S/C19H30N2S/c1-22-19-8-6-17(7-9-19)16-20-14-10-18(11-15-20)21-12-4-2-3-5-13-21/h6-9,18H,2-5,10-16H2,1H3