3-ethyl-4-oxidanyl-2-prop-2-enylsulfanyl-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)-1,2-dihydropyrimidin-6-one

Systemtic Name: 3-ethyl-4-oxidanyl-2-prop-2-enylsulfanyl-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)-1,2-dihydropyrimidin-6-one Openeye Name: 2-allylsulfanyl-3-ethyl-4-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)-1,2-dihydropyrimidin-6-one CAS Name: 3-ethyl-4-hydroxy-2-(prop-2-enylthio)-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)-1,2-dihydropyrimidin-6-one IUPAC Name: 3-ethyl-4-hydroxy-2-prop-2-enylsulfanyl-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)-1,2-dihydropyrimidin-6-one Traditional Name: 2-(allylthio)-3-ethyl-4-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)-1,2-dihydropyrimidin-6-one Formula: C18H23N3O2S MolecularWeight: 345.45912

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(NC(=O)C(=C1O)C2C3=CC=CC=C3CCN2)SCC=C

Isomeric SMILES

CCN1C(NC(=O)C(=C1O)C2C3=CC=CC=C3CCN2)SCC=C

InChI

InChI=1S/C18H23N3O2S/c1-3-11-24-18-20-16(22)14(17(23)21(18)4-2)15-13-8-6-5-7-12(13)9-10-19-15/h3,5-8,15,18-19,23H,1,4,9-11H2,2H3,(H,20,22)