tributyl-[[3-[(4-methoxyphenyl)methyl]-5-methyl-2-oxidanylidene-1,3-thiazol-4-yl]methyl]phosphanium bromide

Systemtic Name: tributyl-[[3-[(4-methoxyphenyl)methyl]-5-methyl-2-oxidanylidene-1,3-thiazol-4-yl]methyl]phosphanium bromide Openeye Name: tributyl-[[3-[(4-methoxyphenyl)methyl]-5-methyl-2-oxo-thiazol-4-yl]methyl]phosphonium bromide CAS Name: tributyl-[[3-[(4-methoxyphenyl)methyl]-5-methyl-2-oxo-4-thiazolyl]methyl]phosphonium bromide IUPAC Name: tributyl-[[3-[(4-methoxyphenyl)methyl]-5-methyl-2-oxo-1,3-thiazol-4-yl]methyl]phosphanium bromide Traditional Name: tributyl-[(2-keto-5-methyl-3-p-anisyl-4-thiazolin-4-yl)methyl]phosphonium bromide Formula: C25H41BrNO2PS MolecularWeight: 530.541301

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[P+](CCCC)(CCCC)CC1=C(SC(=O)N1CC2=CC=C(C=C2)OC)C.[Br-]

Isomeric SMILES

CCCC[P+](CCCC)(CCCC)CC1=C(SC(=O)N1CC2=CC=C(C=C2)OC)C.[Br-]

InChI

InChI=1S/C25H41NO2PS.BrH/c1-6-9-16-29(17-10-7-2,18-11-8-3)20-24-21(4)30-25(27)26(24)19-22-12-14-23(28-5)15-13-22;/h12-15H,6-11,16-20H2,1-5H3;1H/q+1;/p-1