(E)-1-(3-decylphenyl)-3-(4-methylsulfanylphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(3-decylphenyl)-3-(4-methylsulfanylphenyl)prop-2-en-1-one Openeye Name: (E)-1-(3-decylphenyl)-3-(4-methylsulfanylphenyl)prop-2-en-1-one CAS Name: (E)-1-(3-decylphenyl)-3-[4-(methylthio)phenyl]-2-propen-1-one IUPAC Name: (E)-1-(3-decylphenyl)-3-(4-methylsulfanylphenyl)prop-2-en-1-one Traditional Name: (E)-1-(3-decylphenyl)-3-[4-(methylthio)phenyl]prop-2-en-1-one Formula: C26H34OS MolecularWeight: 394.61256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC=CC(=C1)C(=O)C=CC2=CC=C(C=C2)SC

Isomeric SMILES

CCCCCCCCCCC1=CC=CC(=C1)C(=O)/C=C/C2=CC=C(C=C2)SC

InChI

InChI=1S/C26H34OS/c1-3-4-5-6-7-8-9-10-12-23-13-11-14-24(21-23)26(27)20-17-22-15-18-25(28-2)19-16-22/h11,13-21H,3-10,12H2,1-2H3/b20-17+