4-(2,6-diphenylthiopyran-1-ium-4-ylidene)-2,6-diphenyl-thiopyran perchlorate

Systemtic Name: 4-(2,6-diphenylthiopyran-1-ium-4-ylidene)-2,6-diphenyl-thiopyran perchlorate Openeye Name: 4-(2,6-diphenylthiopyran-1-ium-4-ylidene)-2,6-diphenyl-thiopyran perchlorate CAS Name: 4-(2,6-diphenyl-4-thiopyran-1-iumylidene)-2,6-diphenylthiopyran perchlorate IUPAC Name: 4-(2,6-diphenylthiopyran-1-ium-4-ylidene)-2,6-diphenylthiopyran perchlorate Traditional Name: 4-(2,6-diphenylthiopyran-1-ium-4-ylidene)-2,6-diphenyl-thiopyran perchlorate Formula: C34H25ClO4S2 MolecularWeight: 597.1429

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C3C=C(SC(=C3)C4=CC=CC=C4)C5=CC=CC=C5)C=C([SH+]2)C6=CC=CC=C6.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C3C=C(SC(=C3)C4=CC=CC=C4)C5=CC=CC=C5)C=C([SH+]2)C6=CC=CC=C6.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C34H24S2.ClHO4/c1-5-13-25(14-6-1)31-21-29(22-32(35-31)26-15-7-2-8-16-26)30-23-33(27-17-9-3-10-18-27)36-34(24-30)28-19-11-4-12-20-28;2-1(3,4)5/h1-24H;(H,2,3,4,5)