(Q27087869)

CHEMBL1474387 (English)

3 October 2016

chemical formula

C₂₉H₂₆N₂PS⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CC1=C([N+]2=CC=CC=C2N1CC=CC3=CC=CC=C3)P(=S)(C4=CC=CC=C4)C5=CC=CC=C5

1 reference

CHEMBL1474387 (English)

3 October 2016

isomeric SMILES

CC1=C([N+]2=CC=CC=C2N1C/C=C/C3=CC=CC=C3)P(=S)(C4=CC=CC=C4)C5=CC=CC=C5

1 reference

CHEMBL1474387 (English)

InChI=1S/C29H26N2PS/c1-24-29(32(33,26-17-7-3-8-18-26)27-19-9-4-10-20-27)31-22-12-11-21-28(31)30(24)23-13-16-25-14-5-2-6-15-25/h2-22H,23H2,1H3/q+1/b16-13+

3 October 2016

Identifiers

InChI

1 reference

CHEMBL1474387 (English)

VSWYSDPXUHVQCG-DTQAZKPQSA-N

3 October 2016

InChIKey

1 reference

CHEMBL1474387 (English)

3 October 2016

1 reference

3-(Diphenylphosphorothioyl)-2-methyl-1-[(2E)-3-phenyl-2-propen-1-yl]imidazo[1,2-a]pyridin-1-ium (English)

3 October 2016

1 reference

CHEMBL1474387 (English)

3 October 2016

1 reference

Guide to Pharmacology Ligand ID

CHEMBL1622930 (English)

3 October 2016

1 reference

9168

1 reference

stated in

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

9168