2,6-ditert-butyl-4-[(1E,3Z)-5-(2,6-ditert-butylthiopyran-4-ylidene)-3-phenyl-penta-1,3-dienyl]thiopyrylium

Systemtic Name: 2,6-ditert-butyl-4-[(1E,3Z)-5-(2,6-ditert-butylthiopyran-4-ylidene)-3-phenyl-penta-1,3-dienyl]thiopyrylium Openeye Name: 2,6-ditert-butyl-4-[(1E,3Z)-5-(2,6-ditert-butylthiopyran-4-ylidene)-3-phenyl-penta-1,3-dienyl]thiopyrylium CAS Name: 2,6-ditert-butyl-4-[(1E,3Z)-5-(2,6-ditert-butyl-4-thiopyranylidene)-3-phenylpenta-1,3-dienyl]thiopyrylium IUPAC Name: 2,6-ditert-butyl-4-[(1E,3Z)-5-(2,6-ditert-butylthiopyran-4-ylidene)-3-phenylpenta-1,3-dienyl]thiopyrylium Traditional Name: 2,6-ditert-butyl-4-[(1E,3Z)-5-(2,6-ditert-butylthiopyran-4-ylidene)-3-phenyl-penta-1,3-dienyl]thiopyrylium Formula: C37H49S2+ MolecularWeight: 557.91496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC=C(C=CC2=CC(=[S+]C(=C2)C(C)(C)C)C(C)(C)C)C3=CC=CC=C3)C=C(S1)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C/C=C(/C=C/C2=CC(=[S+]C(=C2)C(C)(C)C)C(C)(C)C)\C3=CC=CC=C3)C=C(S1)C(C)(C)C

InChI

InChI=1S/C37H49S2/c1-34(2,3)30-22-26(23-31(38-30)35(4,5)6)18-20-29(28-16-14-13-15-17-28)21-19-27-24-32(36(7,8)9)39-33(25-27)37(10,11)12/h13-25H,1-12H3/q+1