2-hexylsulfanyl-5-[(4-methoxyphenyl)methyl]-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 2-hexylsulfanyl-5-[(4-methoxyphenyl)methyl]-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 2-hexylsulfanyl-4-hydroxy-5-[(4-methoxyphenyl)methyl]-1H-pyrimidin-6-one CAS Name: 2-(hexylthio)-4-hydroxy-5-[(4-methoxyphenyl)methyl]-1H-pyrimidin-6-one IUPAC Name: 2-hexylsulfanyl-4-hydroxy-5-[(4-methoxyphenyl)methyl]-1H-pyrimidin-6-one Traditional Name: 2-(hexylthio)-4-hydroxy-5-p-anisyl-1H-pyrimidin-6-one Formula: C18H24N2O3S MolecularWeight: 348.45976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NC(=C(C(=O)N1)CC2=CC=C(C=C2)OC)O

Isomeric SMILES

CCCCCCSC1=NC(=C(C(=O)N1)CC2=CC=C(C=C2)OC)O

InChI

InChI=1S/C18H24N2O3S/c1-3-4-5-6-11-24-18-19-16(21)15(17(22)20-18)12-13-7-9-14(23-2)10-8-13/h7-10H,3-6,11-12H2,1-2H3,(H2,19,20,21,22)