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

Systemtic Name: diethyl-[2-[[5-(2-methylpropyl)-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]ethyl]azanium Openeye Name: diethyl-[2-[(4-hydroxy-5-isobutyl-6-oxo-1H-pyrimidin-2-yl)sulfanyl]ethyl]ammonium CAS Name: diethyl-[2-[[4-hydroxy-5-(2-methylpropyl)-6-oxo-1H-pyrimidin-2-yl]thio]ethyl]ammonium IUPAC Name: diethyl-[2-[[4-hydroxy-5-(2-methylpropyl)-6-oxo-1H-pyrimidin-2-yl]sulfanyl]ethyl]azanium Traditional Name: diethyl-[2-[(4-hydroxy-5-isobutyl-6-keto-1H-pyrimidin-2-yl)thio]ethyl]ammonium Formula: C14H26N3O2S+ MolecularWeight: 300.44014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H25N3O2S/c1-5-17(6-2)7-8-20-14-15-12(18)11(9-10(3)4)13(19)16-14/h10H,5-9H2,1-4H3,(H2,15,16,18,19)/p+1