(E)-3-(2,4-diethyl-4-ethylsulfanyl-cyclohexa-2,5-dien-1-yl)-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-(2,4-diethyl-4-ethylsulfanyl-cyclohexa-2,5-dien-1-yl)-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-(2,4-diethyl-4-ethylsulfanyl-cyclohexa-2,5-dien-1-yl)-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[2,4-diethyl-4-(ethylthio)-1-cyclohexa-2,5-dienyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-(2,4-diethyl-4-ethylsulfanylcyclohexa-2,5-dien-1-yl)-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[2,4-diethyl-4-(ethylthio)cyclohexa-2,5-dien-1-yl]-1-phenyl-prop-2-en-1-one Formula: C21H26OS MolecularWeight: 326.49554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(C=CC1C=CC(=O)C2=CC=CC=C2)(CC)SCC

Isomeric SMILES

CCC1=CC(C=CC1/C=C/C(=O)C2=CC=CC=C2)(CC)SCC

InChI

InChI=1S/C21H26OS/c1-4-17-16-21(5-2,23-6-3)15-14-18(17)12-13-20(22)19-10-8-7-9-11-19/h7-16,18H,4-6H2,1-3H3/b13-12+