(4-oxidanyl-2-propan-2-yl-5H-1,3-thiazol-4-yl)methyl-triphenyl-phosphanium chloride

Systemtic Name: (4-oxidanyl-2-propan-2-yl-5H-1,3-thiazol-4-yl)methyl-triphenyl-phosphanium chloride Openeye Name: (4-hydroxy-2-isopropyl-5H-thiazol-4-yl)methyl-triphenyl-phosphonium chloride CAS Name: (4-hydroxy-2-propan-2-yl-5H-thiazol-4-yl)methyl-triphenylphosphonium chloride IUPAC Name: (4-hydroxy-2-propan-2-yl-5H-1,3-thiazol-4-yl)methyl-triphenylphosphanium chloride Traditional Name: (4-hydroxy-2-isopropyl-2-thiazolin-4-yl)methyl-triphenyl-phosphonium chloride Formula: C25H27ClNOPS MolecularWeight: 455.979741

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(CS1)(C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)O.[Cl-]

Isomeric SMILES

CC(C)C1=NC(CS1)(C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)O.[Cl-]

InChI

InChI=1S/C25H27NOPS.ClH/c1-20(2)24-26-25(27,19-29-24)18-28(21-12-6-3-7-13-21,22-14-8-4-9-15-22)23-16-10-5-11-17-23;/h3-17,20,27H,18-19H2,1-2H3;1H/q+1;/p-1