2-phenethylsulfanyl-1H-pyrimidin-6-one

Systemtic Name: 2-phenethylsulfanyl-1H-pyrimidin-6-one Openeye Name: 2-phenethylsulfanyl-1H-pyrimidin-6-one CAS Name: 2-(phenethylthio)-1H-pyrimidin-6-one IUPAC Name: 2-phenethylsulfanyl-1H-pyrimidin-6-one Traditional Name: 2-(phenethylthio)-1H-pyrimidin-6-one Formula: C12H12N2OS MolecularWeight: 232.30148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCSC2=NC=CC(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)CCSC2=NC=CC(=O)N2

InChI

InChI=1S/C12H12N2OS/c15-11-6-8-13-12(14-11)16-9-7-10-4-2-1-3-5-10/h1-6,8H,7,9H2,(H,13,14,15)