dimethyl-[2-(6-oxidanyl-4-oxidanylidene-1,5-diphenyl-pyrimidin-2-yl)sulfanylethyl]azanium

Systemtic Name: dimethyl-[2-(6-oxidanyl-4-oxidanylidene-1,5-diphenyl-pyrimidin-2-yl)sulfanylethyl]azanium Openeye Name: 2-(6-hydroxy-4-oxo-1,5-diphenyl-pyrimidin-2-yl)sulfanylethyl-dimethyl-ammonium CAS Name: 2-[(6-hydroxy-4-oxo-1,5-diphenyl-2-pyrimidinyl)thio]ethyl-dimethylammonium IUPAC Name: 2-(6-hydroxy-4-oxo-1,5-diphenylpyrimidin-2-yl)sulfanylethyl-dimethylazanium Traditional Name: 2-[(6-hydroxy-4-keto-1,5-diphenyl-pyrimidin-2-yl)thio]ethyl-dimethyl-ammonium Formula: C20H22N3O2S+ MolecularWeight: 368.47258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCSC1=NC(=O)C(=C(N1C2=CC=CC=C2)O)C3=CC=CC=C3

Isomeric SMILES

C[NH+](C)CCSC1=NC(=O)C(=C(N1C2=CC=CC=C2)O)C3=CC=CC=C3

InChI

InChI=1S/C20H21N3O2S/c1-22(2)13-14-26-20-21-18(24)17(15-9-5-3-6-10-15)19(25)23(20)16-11-7-4-8-12-16/h3-12,25H,13-14H2,1-2H3/p+1