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

Systemtic Name: 2-butylsulfanyl-4-oxidanyl-5-[(4-prop-2-enoxyphenyl)methyl]-1H-pyrimidin-6-one Openeye Name: 5-[(4-allyloxyphenyl)methyl]-2-butylsulfanyl-4-hydroxy-1H-pyrimidin-6-one CAS Name: 2-(butylthio)-4-hydroxy-5-[(4-prop-2-enoxyphenyl)methyl]-1H-pyrimidin-6-one IUPAC Name: 2-butylsulfanyl-4-hydroxy-5-[(4-prop-2-enoxyphenyl)methyl]-1H-pyrimidin-6-one Traditional Name: 5-(4-allyloxybenzyl)-2-(butylthio)-4-hydroxy-1H-pyrimidin-6-one Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(=C(C(=O)N1)CC2=CC=C(C=C2)OCC=C)O

Isomeric SMILES

CCCCSC1=NC(=C(C(=O)N1)CC2=CC=C(C=C2)OCC=C)O

InChI

InChI=1S/C18H22N2O3S/c1-3-5-11-24-18-19-16(21)15(17(22)20-18)12-13-6-8-14(9-7-13)23-10-4-2/h4,6-9H,2-3,5,10-12H2,1H3,(H2,19,20,21,22)