5-ethyl-6-oxidanyl-2-phenacylsulfanyl-1-prop-2-enyl-pyrimidin-4-one

Systemtic Name: 5-ethyl-6-oxidanyl-2-phenacylsulfanyl-1-prop-2-enyl-pyrimidin-4-one Openeye Name: 1-allyl-5-ethyl-6-hydroxy-2-phenacylsulfanyl-pyrimidin-4-one CAS Name: 5-ethyl-6-hydroxy-2-(phenacylthio)-1-prop-2-enyl-4-pyrimidinone IUPAC Name: 5-ethyl-6-hydroxy-2-phenacylsulfanyl-1-prop-2-enylpyrimidin-4-one Traditional Name: 1-allyl-5-ethyl-6-hydroxy-2-(phenacylthio)pyrimidin-4-one Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=NC1=O)SCC(=O)C2=CC=CC=C2)CC=C)O

Isomeric SMILES

CCC1=C(N(C(=NC1=O)SCC(=O)C2=CC=CC=C2)CC=C)O

InChI

InChI=1S/C17H18N2O3S/c1-3-10-19-16(22)13(4-2)15(21)18-17(19)23-11-14(20)12-8-6-5-7-9-12/h3,5-9,22H,1,4,10-11H2,2H3