5,5-dimethyl-3-[(3-methylsulfanylphenyl)amino]cyclohex-2-en-1-one

Systemtic Name: 5,5-dimethyl-3-[(3-methylsulfanylphenyl)amino]cyclohex-2-en-1-one Openeye Name: 5,5-dimethyl-3-(3-methylsulfanylanilino)cyclohex-2-en-1-one CAS Name: 5,5-dimethyl-3-[3-(methylthio)anilino]-1-cyclohex-2-enone IUPAC Name: 5,5-dimethyl-3-(3-methylsulfanylanilino)cyclohex-2-en-1-one Traditional Name: 5,5-dimethyl-3-[3-(methylthio)anilino]cyclohex-2-en-1-one Formula: C15H19NOS MolecularWeight: 261.38246

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=O)C1)NC2=CC(=CC=C2)SC)C

Isomeric SMILES

CC1(CC(=CC(=O)C1)NC2=CC(=CC=C2)SC)C

InChI

InChI=1S/C15H19NOS/c1-15(2)9-12(7-13(17)10-15)16-11-5-4-6-14(8-11)18-3/h4-8,16H,9-10H2,1-3H3