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

Systemtic Name: (2-tert-butyl-4-sulfanyl-1H-imidazol-5-yl)-triphenyl-phosphanium Openeye Name: (2-tert-butyl-4-sulfanyl-1H-imidazol-5-yl)-triphenyl-phosphonium CAS Name: (2-tert-butyl-4-mercapto-1H-imidazol-5-yl)-triphenylphosphonium IUPAC Name: (2-tert-butyl-4-sulfanyl-1H-imidazol-5-yl)-triphenylphosphanium Traditional Name: (2-tert-butyl-4-mercapto-1H-imidazol-5-yl)-triphenyl-phosphonium Formula: C25H26N2PS+ MolecularWeight: 417.526101

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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)S

Isomeric SMILES

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

InChI

InChI=1S/C25H25N2PS/c1-25(2,3)24-26-22(23(29)27-24)28(19-13-7-4-8-14-19,20-15-9-5-10-16-20)21-17-11-6-12-18-21/h4-18H,1-3H3,(H-,26,27,29)/p+1