4-oxidanyl-5-phenyl-2-(sulfanylmethyl)-1H-pyrimidin-6-one

Systemtic Name: 4-oxidanyl-5-phenyl-2-(sulfanylmethyl)-1H-pyrimidin-6-one Openeye Name: 4-hydroxy-5-phenyl-2-(sulfanylmethyl)-1H-pyrimidin-6-one CAS Name: 4-hydroxy-2-(mercaptomethyl)-5-phenyl-1H-pyrimidin-6-one IUPAC Name: 4-hydroxy-5-phenyl-2-(sulfanylmethyl)-1H-pyrimidin-6-one Traditional Name: 4-hydroxy-2-(mercaptomethyl)-5-phenyl-1H-pyrimidin-6-one Formula: C11H10N2O2S MolecularWeight: 234.2743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=C(NC2=O)CS)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=C(NC2=O)CS)O

InChI

InChI=1S/C11H10N2O2S/c14-10-9(7-4-2-1-3-5-7)11(15)13-8(6-16)12-10/h1-5,16H,6H2,(H2,12,13,14,15)