2-[2-(1,3-dioxan-2-yl)ethylsulfanyl]-5-ethyl-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-(1,3-dioxan-2-yl)ethylsulfanyl]-5-ethyl-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[2-(1,3-dioxan-2-yl)ethylsulfanyl]-5-ethyl-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[2-(1,3-dioxan-2-yl)ethylthio]-5-ethyl-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(1,3-dioxan-2-yl)ethylsulfanyl]-5-ethyl-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[2-(1,3-dioxan-2-yl)ethylthio]-5-ethyl-6-methyl-1H-pyrimidin-4-one Formula: C13H20N2O3S MolecularWeight: 284.3745

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)SCCC2OCCCO2)C

Isomeric SMILES

CCC1=C(NC(=NC1=O)SCCC2OCCCO2)C

InChI

InChI=1S/C13H20N2O3S/c1-3-10-9(2)14-13(15-12(10)16)19-8-5-11-17-6-4-7-18-11/h11H,3-8H2,1-2H3,(H,14,15,16)