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

Systemtic Name: 2-[4-(3,3-diphenyl-2-benzothiophen-1-ylidene)cyclohexa-2,5-dien-1-ylidene]-3,5-diphenyl-3,4-dihydropyrazol-2-ium Openeye Name: 2-[4-(3,3-diphenyl-2-benzothiophen-1-ylidene)cyclohexa-2,5-dien-1-ylidene]-3,5-diphenyl-3,4-dihydropyrazol-2-ium CAS Name: 2-[4-(3,3-diphenyl-2-benzothiophen-1-ylidene)-1-cyclohexa-2,5-dienylidene]-3,5-diphenyl-3,4-dihydropyrazol-2-ium IUPAC Name: 2-[4-(3,3-diphenyl-2-benzothiophen-1-ylidene)cyclohexa-2,5-dien-1-ylidene]-3,5-diphenyl-3,4-dihydropyrazol-2-ium Traditional Name: 1-[4-(3,3-diphenylisobenzothiophen-1-ylidene)cyclohexa-2,5-dien-1-ylidene]-3,5-diphenyl-2-pyrazolin-1-ium Formula: C41H31N2S+ MolecularWeight: 583.76324

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Descriptors Computed from Structure

Canonical SMILES:

C1C([N+](=C2C=CC(=C3C4=CC=CC=C4C(S3)(C5=CC=CC=C5)C6=CC=CC=C6)C=C2)N=C1C7=CC=CC=C7)C8=CC=CC=C8

Isomeric SMILES

C1C([N+](=C2C=CC(=C3C4=CC=CC=C4C(S3)(C5=CC=CC=C5)C6=CC=CC=C6)C=C2)N=C1C7=CC=CC=C7)C8=CC=CC=C8

InChI

InChI=1S/C41H31N2S/c1-5-15-30(16-6-1)38-29-39(31-17-7-2-8-18-31)43(42-38)35-27-25-32(26-28-35)40-36-23-13-14-24-37(36)41(44-40,33-19-9-3-10-20-33)34-21-11-4-12-22-34/h1-28,39H,29H2/q+1