2-butan-2-ylsulfanyl-1-[4-(phenylmethyl)piperidin-1-yl]ethanone

Systemtic Name: 2-butan-2-ylsulfanyl-1-[4-(phenylmethyl)piperidin-1-yl]ethanone Openeye Name: 1-(4-benzyl-1-piperidyl)-2-sec-butylsulfanyl-ethanone CAS Name: 2-(butan-2-ylthio)-1-[4-(phenylmethyl)-1-piperidinyl]ethanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-2-butan-2-ylsulfanylethanone Traditional Name: 1-(4-benzylpiperidino)-2-(sec-butylthio)ethanone Formula: C18H27NOS MolecularWeight: 305.47808

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SCC(=O)N1CCC(CC1)CC2=CC=CC=C2

Isomeric SMILES

CCC(C)SCC(=O)N1CCC(CC1)CC2=CC=CC=C2

InChI

InChI=1S/C18H27NOS/c1-3-15(2)21-14-18(20)19-11-9-17(10-12-19)13-16-7-5-4-6-8-16/h4-8,15,17H,3,9-14H2,1-2H3