5-ethyl-2-(phenylmethylsulfanyl)-1H-pyrimidine-4,6-dione

Systemtic Name: 5-ethyl-2-(phenylmethylsulfanyl)-1H-pyrimidine-4,6-dione Openeye Name: 2-benzylsulfanyl-5-ethyl-1H-pyrimidine-4,6-dione CAS Name: 5-ethyl-2-(phenylmethylthio)-1H-pyrimidine-4,6-dione IUPAC Name: 2-benzylsulfanyl-5-ethyl-1H-pyrimidine-4,6-dione Traditional Name: 2-(benzylthio)-5-ethyl-1H-pyrimidine-4,6-quinone Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)NC(=NC1=O)SCC2=CC=CC=C2

Isomeric SMILES

CCC1C(=O)NC(=NC1=O)SCC2=CC=CC=C2

InChI

InChI=1S/C13H14N2O2S/c1-2-10-11(16)14-13(15-12(10)17)18-8-9-6-4-3-5-7-9/h3-7,10H,2,8H2,1H3,(H,14,15,16,17)