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

Systemtic Name: 2,6-ditert-butyl-4-[(1E,3E)-5-(2,6-ditert-butylthiopyran-4-ylidene)penta-1,3-dienyl]thiopyrylium tetrafluoroborate Openeye Name: 2,6-ditert-butyl-4-[(1E,3E)-5-(2,6-ditert-butylthiopyran-4-ylidene)penta-1,3-dienyl]thiopyrylium tetrafluoroborate CAS Name: 2,6-ditert-butyl-4-[(1E,3E)-5-(2,6-ditert-butyl-4-thiopyranylidene)penta-1,3-dienyl]thiopyrylium tetrafluoroborate IUPAC Name: 2,6-ditert-butyl-4-[(1E,3E)-5-(2,6-ditert-butylthiopyran-4-ylidene)penta-1,3-dienyl]thiopyrylium tetrafluoroborate Traditional Name: 2,6-ditert-butyl-4-[(1E,3E)-5-(2,6-ditert-butylthiopyran-4-ylidene)penta-1,3-dienyl]thiopyrylium tetrafluoroborate Formula: C31H45BF4S2 MolecularWeight: 568.623613

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC(C)(C)C1=CC(=CC=CC=CC2=CC(=[S+]C(=C2)C(C)(C)C)C(C)(C)C)C=C(S1)C(C)(C)C

Isomeric SMILES

[B-](F)(F)(F)F.CC(C)(C)C1=CC(=C/C=C/C=C/C2=CC(=[S+]C(=C2)C(C)(C)C)C(C)(C)C)C=C(S1)C(C)(C)C

InChI

InChI=1S/C31H45S2.BF4/c1-28(2,3)24-18-22(19-25(32-24)29(4,5)6)16-14-13-15-17-23-20-26(30(7,8)9)33-27(21-23)31(10,11)12;2-1(3,4)5/h13-21H,1-12H3;/q+1;-1