2-methyl-3-phenylsulfanyl-cyclohex-2-en-1-one

Systemtic Name: 2-methyl-3-phenylsulfanyl-cyclohex-2-en-1-one Openeye Name: 2-methyl-3-phenylsulfanyl-cyclohex-2-en-1-one CAS Name: 2-methyl-3-(phenylthio)-1-cyclohex-2-enone IUPAC Name: 2-methyl-3-phenylsulfanylcyclohex-2-en-1-one Traditional Name: 2-methyl-3-(phenylthio)cyclohex-2-en-1-one Formula: C13H14OS MolecularWeight: 218.31466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CCCC1=O)SC2=CC=CC=C2

Isomeric SMILES

CC1=C(CCCC1=O)SC2=CC=CC=C2

InChI

InChI=1S/C13H14OS/c1-10-12(14)8-5-9-13(10)15-11-6-3-2-4-7-11/h2-4,6-7H,5,8-9H2,1H3