2-[3,5-ditert-butyl-2-(3,5-ditert-butyl-4-ethoxy-phenyl)-4-oxidanylidene-6-sulfanyl-cyclohexa-2,5-dien-1-yl]propanethial

Systemtic Name: 2-[3,5-ditert-butyl-2-(3,5-ditert-butyl-4-ethoxy-phenyl)-4-oxidanylidene-6-sulfanyl-cyclohexa-2,5-dien-1-yl]propanethial Openeye Name: 2-[3,5-ditert-butyl-2-(3,5-ditert-butyl-4-ethoxy-phenyl)-4-oxo-6-sulfanyl-cyclohexa-2,5-dien-1-yl]propanethial CAS Name: 2-[3,5-ditert-butyl-2-(3,5-ditert-butyl-4-ethoxyphenyl)-6-mercapto-4-oxo-1-cyclohexa-2,5-dienyl]propanethial IUPAC Name: 2-[3,5-ditert-butyl-2-(3,5-ditert-butyl-4-ethoxyphenyl)-4-oxo-6-sulfanylcyclohexa-2,5-dien-1-yl]propanethial Traditional Name: 2-[3,5-ditert-butyl-2-(3,5-ditert-butyl-4-ethoxy-phenyl)-4-keto-6-mercapto-cyclohexa-2,5-dien-1-yl]thiopropionaldehyde Formula: C33H50O2S2 MolecularWeight: 542.8789

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1C(C)(C)C)C2=C(C(=O)C(=C(C2C(C)C=S)S)C(C)(C)C)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1C(C)(C)C)C2=C(C(=O)C(=C(C2C(C)C=S)S)C(C)(C)C)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C33H50O2S2/c1-15-35-28-21(30(3,4)5)16-20(17-22(28)31(6,7)8)24-23(19(2)18-36)29(37)26(33(12,13)14)27(34)25(24)32(9,10)11/h16-19,23,37H,15H2,1-14H3