5-[(4-ethoxyphenyl)methyl]-4-oxidanyl-2-prop-2-enylsulfanyl-1H-pyrimidin-6-one

Systemtic Name: 5-[(4-ethoxyphenyl)methyl]-4-oxidanyl-2-prop-2-enylsulfanyl-1H-pyrimidin-6-one Openeye Name: 2-allylsulfanyl-5-[(4-ethoxyphenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one CAS Name: 5-[(4-ethoxyphenyl)methyl]-4-hydroxy-2-(prop-2-enylthio)-1H-pyrimidin-6-one IUPAC Name: 5-[(4-ethoxyphenyl)methyl]-4-hydroxy-2-prop-2-enylsulfanyl-1H-pyrimidin-6-one Traditional Name: 2-(allylthio)-5-(4-ethoxybenzyl)-4-hydroxy-1H-pyrimidin-6-one Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC2=C(N=C(NC2=O)SCC=C)O

Isomeric SMILES

CCOC1=CC=C(C=C1)CC2=C(N=C(NC2=O)SCC=C)O

InChI

InChI=1S/C16H18N2O3S/c1-3-9-22-16-17-14(19)13(15(20)18-16)10-11-5-7-12(8-6-11)21-4-2/h3,5-8H,1,4,9-10H2,2H3,(H2,17,18,19,20)