1-[3-[4-(3-methylbutylsulfanyl)phenyl]propyl]piperidin-4-one

Systemtic Name: 1-[3-[4-(3-methylbutylsulfanyl)phenyl]propyl]piperidin-4-one Openeye Name: 1-[3-(4-isopentylsulfanylphenyl)propyl]piperidin-4-one CAS Name: 1-[3-[4-(3-methylbutylthio)phenyl]propyl]-4-piperidinone IUPAC Name: 1-[3-[4-(3-methylbutylsulfanyl)phenyl]propyl]piperidin-4-one Traditional Name: 1-[3-[4-(isoamylthio)phenyl]propyl]-4-piperidone Formula: C19H29NOS MolecularWeight: 319.50466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=CC=C(C=C1)CCCN2CCC(=O)CC2

Isomeric SMILES

CC(C)CCSC1=CC=C(C=C1)CCCN2CCC(=O)CC2

InChI

InChI=1S/C19H29NOS/c1-16(2)11-15-22-19-7-5-17(6-8-19)4-3-12-20-13-9-18(21)10-14-20/h5-8,16H,3-4,9-15H2,1-2H3