3,4-bis(bromanyl)-2-(2,6-ditert-butylthiopyran-4-ylidene)-5-(2,6-ditert-butylthiopyrylium-4-yl)pyrrole

Systemtic Name: 3,4-bis(bromanyl)-2-(2,6-ditert-butylthiopyran-4-ylidene)-5-(2,6-ditert-butylthiopyrylium-4-yl)pyrrole Openeye Name: 3,4-dibromo-2-(2,6-ditert-butylthiopyran-4-ylidene)-5-(2,6-ditert-butylthiopyrylium-4-yl)pyrrole CAS Name: 3,4-dibromo-2-(2,6-ditert-butyl-4-thiopyranylidene)-5-(2,6-ditert-butyl-4-thiopyryliumyl)pyrrole IUPAC Name: 3,4-dibromo-2-(2,6-ditert-butylthiopyran-4-ylidene)-5-(2,6-ditert-butylthiopyrylium-4-yl)pyrrole Traditional Name: 3,4-dibromo-2-(2,6-ditert-butylthiopyran-4-ylidene)-5-(2,6-ditert-butylthiopyrylium-4-yl)pyrrole Formula: C30H40Br2NS2+ MolecularWeight: 638.5833

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C(=C(C(=N2)C3=CC(=[S+]C(=C3)C(C)(C)C)C(C)(C)C)Br)Br)C=C(S1)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C2C(=C(C(=N2)C3=CC(=[S+]C(=C3)C(C)(C)C)C(C)(C)C)Br)Br)C=C(S1)C(C)(C)C

InChI

InChI=1S/C30H40Br2NS2/c1-27(2,3)19-13-17(14-20(34-19)28(4,5)6)25-23(31)24(32)26(33-25)18-15-21(29(7,8)9)35-22(16-18)30(10,11)12/h13-16H,1-12H3/q+1