4-oxidanyl-5-(2-pentylsulfanylethyl)-2-(phenylmethyl)-1H-pyrimidin-6-one

Systemtic Name: 4-oxidanyl-5-(2-pentylsulfanylethyl)-2-(phenylmethyl)-1H-pyrimidin-6-one Openeye Name: 2-benzyl-4-hydroxy-5-(2-pentylsulfanylethyl)-1H-pyrimidin-6-one CAS Name: 4-hydroxy-5-[2-(pentylthio)ethyl]-2-(phenylmethyl)-1H-pyrimidin-6-one IUPAC Name: 2-benzyl-4-hydroxy-5-(2-pentylsulfanylethyl)-1H-pyrimidin-6-one Traditional Name: 5-[2-(amylthio)ethyl]-2-benzyl-4-hydroxy-1H-pyrimidin-6-one Formula: C18H24N2O2S MolecularWeight: 332.46036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSCCC1=C(N=C(NC1=O)CC2=CC=CC=C2)O

Isomeric SMILES

CCCCCSCCC1=C(N=C(NC1=O)CC2=CC=CC=C2)O

InChI

InChI=1S/C18H24N2O2S/c1-2-3-7-11-23-12-10-15-17(21)19-16(20-18(15)22)13-14-8-5-4-6-9-14/h4-6,8-9H,2-3,7,10-13H2,1H3,(H2,19,20,21,22)