diethyl-[2-(6-oxidanyl-4-oxidanylidene-1-phenyl-5-propan-2-yl-pyrimidin-2-yl)sulfanylethyl]azanium chloride

Systemtic Name: diethyl-[2-(6-oxidanyl-4-oxidanylidene-1-phenyl-5-propan-2-yl-pyrimidin-2-yl)sulfanylethyl]azanium chloride Openeye Name: diethyl-[2-(6-hydroxy-5-isopropyl-4-oxo-1-phenyl-pyrimidin-2-yl)sulfanylethyl]ammonium chloride CAS Name: diethyl-[2-[(6-hydroxy-4-oxo-1-phenyl-5-propan-2-yl-2-pyrimidinyl)thio]ethyl]ammonium chloride IUPAC Name: diethyl-[2-(6-hydroxy-4-oxo-1-phenyl-5-propan-2-ylpyrimidin-2-yl)sulfanylethyl]azanium chloride Traditional Name: diethyl-[2-[(6-hydroxy-5-isopropyl-4-keto-1-phenyl-pyrimidin-2-yl)thio]ethyl]ammonium chloride Formula: C19H28ClN3O2S MolecularWeight: 397.96252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCSC1=NC(=O)C(=C(N1C2=CC=CC=C2)O)C(C)C.[Cl-]

Isomeric SMILES

CC[NH+](CC)CCSC1=NC(=O)C(=C(N1C2=CC=CC=C2)O)C(C)C.[Cl-]

InChI

InChI=1S/C19H27N3O2S.ClH/c1-5-21(6-2)12-13-25-19-20-17(23)16(14(3)4)18(24)22(19)15-10-8-7-9-11-15;/h7-11,14,24H,5-6,12-13H2,1-4H3;1H