2-(5-dimorpholin-4-ylphosphinothioyl-4-phenyl-1,3-thiazol-2-yl)ethenyl-dimethyl-azanium

Systemtic Name: 2-(5-dimorpholin-4-ylphosphinothioyl-4-phenyl-1,3-thiazol-2-yl)ethenyl-dimethyl-azanium Openeye Name: 2-(5-dimorpholinophosphinothioyl-4-phenyl-thiazol-2-yl)vinyl-dimethyl-ammonium CAS Name: 2-[5-[bis(4-morpholinyl)phosphinothioyl]-4-phenyl-2-thiazolyl]ethenyl-dimethylammonium IUPAC Name: 2-(5-dimorpholin-4-ylphosphinothioyl-4-phenyl-1,3-thiazol-2-yl)ethenyl-dimethylazanium Traditional Name: 2-(5-dimorpholinothiophosphoryl-4-phenyl-thiazol-2-yl)vinyl-dimethyl-ammonium Formula: C21H30N4O2PS2+ MolecularWeight: 465.592261

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C=CC1=NC(=C(S1)P(=S)(N2CCOCC2)N3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

C[NH+](C)C=CC1=NC(=C(S1)P(=S)(N2CCOCC2)N3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C21H29N4O2PS2/c1-23(2)9-8-19-22-20(18-6-4-3-5-7-18)21(30-19)28(29,24-10-14-26-15-11-24)25-12-16-27-17-13-25/h3-9H,10-17H2,1-2H3/p+1