diethyl-[2-[(4-oxidanyl-6-oxidanylidene-5-propan-2-yl-1H-pyrimidin-2-yl)sulfanyl]ethyl]azanium

Systemtic Name: diethyl-[2-[(4-oxidanyl-6-oxidanylidene-5-propan-2-yl-1H-pyrimidin-2-yl)sulfanyl]ethyl]azanium Openeye Name: diethyl-[2-[(4-hydroxy-5-isopropyl-6-oxo-1H-pyrimidin-2-yl)sulfanyl]ethyl]ammonium CAS Name: diethyl-[2-[(4-hydroxy-6-oxo-5-propan-2-yl-1H-pyrimidin-2-yl)thio]ethyl]ammonium IUPAC Name: diethyl-[2-[(4-hydroxy-6-oxo-5-propan-2-yl-1H-pyrimidin-2-yl)sulfanyl]ethyl]azanium Traditional Name: diethyl-[2-[(4-hydroxy-5-isopropyl-6-keto-1H-pyrimidin-2-yl)thio]ethyl]ammonium Formula: C13H24N3O2S+ MolecularWeight: 286.41356

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCSC1=NC(=C(C(=O)N1)C(C)C)O

Isomeric SMILES

CC[NH+](CC)CCSC1=NC(=C(C(=O)N1)C(C)C)O

InChI

InChI=1S/C13H23N3O2S/c1-5-16(6-2)7-8-19-13-14-11(17)10(9(3)4)12(18)15-13/h9H,5-8H2,1-4H3,(H2,14,15,17,18)/p+1