5-methyl-1-[4-[(E)-4-[methyl(prop-2-enyl)amino]but-2-enoxy]-2-methylsulfanyl-phenyl]hex-4-en-1-one

Systemtic Name: 5-methyl-1-[4-[(E)-4-[methyl(prop-2-enyl)amino]but-2-enoxy]-2-methylsulfanyl-phenyl]hex-4-en-1-one Openeye Name: 1-[4-[(E)-4-[allyl(methyl)amino]but-2-enoxy]-2-methylsulfanyl-phenyl]-5-methyl-hex-4-en-1-one CAS Name: 5-methyl-1-[4-[(E)-4-[methyl(prop-2-enyl)amino]but-2-enoxy]-2-(methylthio)phenyl]-4-hexen-1-one IUPAC Name: 5-methyl-1-[4-[(E)-4-[methyl(prop-2-enyl)amino]but-2-enoxy]-2-methylsulfanylphenyl]hex-4-en-1-one Traditional Name: 1-[4-[(E)-4-[allyl(methyl)amino]but-2-enoxy]-2-(methylthio)phenyl]-5-methyl-hex-4-en-1-one Formula: C22H31NO2S MolecularWeight: 373.55204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=O)C1=C(C=C(C=C1)OCC=CCN(C)CC=C)SC)C

Isomeric SMILES

CC(=CCCC(=O)C1=C(C=C(C=C1)OC/C=C/CN(C)CC=C)SC)C

InChI

InChI=1S/C22H31NO2S/c1-6-14-23(4)15-7-8-16-25-19-12-13-20(22(17-19)26-5)21(24)11-9-10-18(2)3/h6-8,10,12-13,17H,1,9,11,14-16H2,2-5H3/b8-7+