(E)-1-phenyl-3-(2,3,6-trimethoxy-4-octadecyl-phenyl)prop-2-ene-1-thione

Systemtic Name: (E)-1-phenyl-3-(2,3,6-trimethoxy-4-octadecyl-phenyl)prop-2-ene-1-thione Openeye Name: (E)-1-phenyl-3-(2,3,6-trimethoxy-4-octadecyl-phenyl)prop-2-ene-1-thione CAS Name: (E)-1-phenyl-3-(2,3,6-trimethoxy-4-octadecylphenyl)-2-propene-1-thione IUPAC Name: (E)-1-phenyl-3-(2,3,6-trimethoxy-4-octadecylphenyl)prop-2-ene-1-thione Traditional Name: (E)-1-phenyl-3-(2,3,6-trimethoxy-4-stearyl-phenyl)prop-2-ene-1-thione Formula: C36H54O3S MolecularWeight: 566.87716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=CC(=C(C(=C1OC)OC)C=CC(=S)C2=CC=CC=C2)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=CC(=C(C(=C1OC)OC)/C=C/C(=S)C2=CC=CC=C2)OC

InChI

InChI=1S/C36H54O3S/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-26-31-29-33(37-2)32(36(39-4)35(31)38-3)27-28-34(40)30-24-22-20-23-25-30/h20,22-25,27-29H,5-19,21,26H2,1-4H3/b28-27+