2,6-ditert-butyl-4-[3-methyl-5-(triphenylmethyl)thiophen-2-yl]thiopyrylium

Systemtic Name: 2,6-ditert-butyl-4-[3-methyl-5-(triphenylmethyl)thiophen-2-yl]thiopyrylium Openeye Name: 2,6-ditert-butyl-4-(3-methyl-5-trityl-2-thienyl)thiopyrylium CAS Name: 2,6-ditert-butyl-4-[3-methyl-5-(triphenylmethyl)-2-thiophenyl]thiopyrylium IUPAC Name: 2,6-ditert-butyl-4-(3-methyl-5-tritylthiophen-2-yl)thiopyrylium Traditional Name: 2,6-ditert-butyl-4-(3-methyl-5-trityl-2-thienyl)thiopyrylium Formula: C37H39S2+ MolecularWeight: 547.83556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC(=[S+]C(=C5)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC1=C(SC(=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC(=[S+]C(=C5)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C37H39S2/c1-26-23-33(39-34(26)27-24-31(35(2,3)4)38-32(25-27)36(5,6)7)37(28-17-11-8-12-18-28,29-19-13-9-14-20-29)30-21-15-10-16-22-30/h8-25H,1-7H3/q+1