(E)-3-(3-butyl-4-ethylsulfanyl-phenyl)-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-(3-butyl-4-ethylsulfanyl-phenyl)-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-(3-butyl-4-ethylsulfanyl-phenyl)-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[3-butyl-4-(ethylthio)phenyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-(3-butyl-4-ethylsulfanylphenyl)-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[3-butyl-4-(ethylthio)phenyl]-1-phenyl-prop-2-en-1-one Formula: C21H24OS MolecularWeight: 324.47966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1)C=CC(=O)C2=CC=CC=C2)SCC

Isomeric SMILES

CCCCC1=C(C=CC(=C1)/C=C/C(=O)C2=CC=CC=C2)SCC

InChI

InChI=1S/C21H24OS/c1-3-5-9-19-16-17(13-15-21(19)23-4-2)12-14-20(22)18-10-7-6-8-11-18/h6-8,10-16H,3-5,9H2,1-2H3/b14-12+