2-ethylsulfanyl-1-(4-methylphenyl)-6-oxidanyl-5-(phenylmethyl)pyrimidin-4-one

Systemtic Name: 2-ethylsulfanyl-1-(4-methylphenyl)-6-oxidanyl-5-(phenylmethyl)pyrimidin-4-one Openeye Name: 5-benzyl-2-ethylsulfanyl-6-hydroxy-1-(p-tolyl)pyrimidin-4-one CAS Name: 2-(ethylthio)-6-hydroxy-1-(4-methylphenyl)-5-(phenylmethyl)-4-pyrimidinone IUPAC Name: 5-benzyl-2-ethylsulfanyl-6-hydroxy-1-(4-methylphenyl)pyrimidin-4-one Traditional Name: 5-benzyl-2-(ethylthio)-6-hydroxy-1-(p-tolyl)pyrimidin-4-one Formula: C20H20N2O2S MolecularWeight: 352.45

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=O)C(=C(N1C2=CC=C(C=C2)C)O)CC3=CC=CC=C3

Isomeric SMILES

CCSC1=NC(=O)C(=C(N1C2=CC=C(C=C2)C)O)CC3=CC=CC=C3

InChI

InChI=1S/C20H20N2O2S/c1-3-25-20-21-18(23)17(13-15-7-5-4-6-8-15)19(24)22(20)16-11-9-14(2)10-12-16/h4-12,24H,3,13H2,1-2H3