(2-tert-butyl-4-methylsulfanyl-1H-imidazol-5-yl)-triphenyl-phosphanium

Systemtic Name: (2-tert-butyl-4-methylsulfanyl-1H-imidazol-5-yl)-triphenyl-phosphanium Openeye Name: (2-tert-butyl-4-methylsulfanyl-1H-imidazol-5-yl)-triphenyl-phosphonium CAS Name: [2-tert-butyl-4-(methylthio)-1H-imidazol-5-yl]-triphenylphosphonium IUPAC Name: (2-tert-butyl-4-methylsulfanyl-1H-imidazol-5-yl)-triphenylphosphanium Traditional Name: [2-tert-butyl-4-(methylthio)-1H-imidazol-5-yl]-triphenyl-phosphonium Formula: C26H28N2PS+ MolecularWeight: 431.552681

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=C(N1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)SC

Isomeric SMILES

CC(C)(C)C1=NC(=C(N1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)SC

InChI

InChI=1S/C26H28N2PS/c1-26(2,3)25-27-23(24(28-25)30-4)29(20-14-8-5-9-15-20,21-16-10-6-11-17-21)22-18-12-7-13-19-22/h5-19H,1-4H3,(H,27,28)/q+1