1-phenyl-1-(2-pyridin-4-ylethylsulfanyl)propan-2-one

Systemtic Name: 1-phenyl-1-(2-pyridin-4-ylethylsulfanyl)propan-2-one Openeye Name: 1-phenyl-1-[2-(4-pyridyl)ethylsulfanyl]propan-2-one CAS Name: 1-phenyl-1-(2-pyridin-4-ylethylthio)-2-propanone IUPAC Name: 1-phenyl-1-(2-pyridin-4-ylethylsulfanyl)propan-2-one Traditional Name: 1-phenyl-1-[2-(4-pyridyl)ethylthio]acetone Formula: C16H17NOS MolecularWeight: 271.37728

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C1=CC=CC=C1)SCCC2=CC=NC=C2

Isomeric SMILES

CC(=O)C(C1=CC=CC=C1)SCCC2=CC=NC=C2

InChI

InChI=1S/C16H17NOS/c1-13(18)16(15-5-3-2-4-6-15)19-12-9-14-7-10-17-11-8-14/h2-8,10-11,16H,9,12H2,1H3