propyl (E)-1-(1,3-oxazol-4-ylmethylsulfanyl)-1,3-diphenyl-prop-2-ene-1-sulfonate

Systemtic Name: propyl (E)-1-(1,3-oxazol-4-ylmethylsulfanyl)-1,3-diphenyl-prop-2-ene-1-sulfonate Openeye Name: propyl (E)-1-(oxazol-4-ylmethylsulfanyl)-1,3-diphenyl-prop-2-ene-1-sulfonate CAS Name: (E)-1-(4-oxazolylmethylthio)-1,3-diphenyl-2-propene-1-sulfonic acid propyl ester IUPAC Name: propyl (E)-1-(1,3-oxazol-4-ylmethylsulfanyl)-1,3-diphenylprop-2-ene-1-sulfonate Traditional Name: (E)-1-(oxazol-4-ylmethylthio)-1,3-diphenyl-prop-2-ene-1-sulfonic acid propyl ester Formula: C22H23NO4S2 MolecularWeight: 429.55232

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Descriptors Computed from Structure

Canonical SMILES:

CCCOS(=O)(=O)C(C=CC1=CC=CC=C1)(C2=CC=CC=C2)SCC3=COC=N3

Isomeric SMILES

CCCOS(=O)(=O)C(/C=C/C1=CC=CC=C1)(C2=CC=CC=C2)SCC3=COC=N3

InChI

InChI=1S/C22H23NO4S2/c1-2-15-27-29(24,25)22(20-11-7-4-8-12-20,28-17-21-16-26-18-23-21)14-13-19-9-5-3-6-10-19/h3-14,16,18H,2,15,17H2,1H3/b14-13+