2-[4-(2,6-diphenylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]-3,5-diphenyl-3,4-dihydropyrazol-2-ium

Systemtic Name: 2-[4-(2,6-diphenylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]-3,5-diphenyl-3,4-dihydropyrazol-2-ium Openeye Name: 2-[4-(2,6-diphenylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]-3,5-diphenyl-3,4-dihydropyrazol-2-ium CAS Name: 2-[4-(2,6-diphenyl-4-thiopyranylidene)-1-cyclohexa-2,5-dienylidene]-3,5-diphenyl-3,4-dihydropyrazol-2-ium IUPAC Name: 2-[4-(2,6-diphenylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]-3,5-diphenyl-3,4-dihydropyrazol-2-ium Traditional Name: 1-[4-(2,6-diphenylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]-3,5-diphenyl-2-pyrazolin-1-ium Formula: C38H29N2S+ MolecularWeight: 545.71526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C([N+](=C2C=CC(=C3C=C(SC(=C3)C4=CC=CC=C4)C5=CC=CC=C5)C=C2)N=C1C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

C1C([N+](=C2C=CC(=C3C=C(SC(=C3)C4=CC=CC=C4)C5=CC=CC=C5)C=C2)N=C1C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C38H29N2S/c1-5-13-29(14-6-1)35-27-36(30-15-7-2-8-16-30)40(39-35)34-23-21-28(22-24-34)33-25-37(31-17-9-3-10-18-31)41-38(26-33)32-19-11-4-12-20-32/h1-26,36H,27H2/q+1