6-oxidanyl-5-[2-(phenylmethylsulfanyl)ethyl]-2-sulfanylidene-1,3-diazinan-4-one

Systemtic Name: 6-oxidanyl-5-[2-(phenylmethylsulfanyl)ethyl]-2-sulfanylidene-1,3-diazinan-4-one Openeye Name: 5-(2-benzylsulfanylethyl)-6-hydroxy-2-thioxo-hexahydropyrimidin-4-one CAS Name: 6-hydroxy-5-[2-(phenylmethylthio)ethyl]-2-sulfanylidene-1,3-diazinan-4-one IUPAC Name: 5-(2-benzylsulfanylethyl)-6-hydroxy-2-sulfanylidene-1,3-diazinan-4-one Traditional Name: 5-[2-(benzylthio)ethyl]-6-hydroxy-2-thioxo-hexahydropyrimidin-4-one Formula: C13H16N2O2S2 MolecularWeight: 296.40834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCC2C(NC(=S)NC2=O)O

Isomeric SMILES

C1=CC=C(C=C1)CSCCC2C(NC(=S)NC2=O)O

InChI

InChI=1S/C13H16N2O2S2/c16-11-10(12(17)15-13(18)14-11)6-7-19-8-9-4-2-1-3-5-9/h1-5,10-11,16H,6-8H2,(H2,14,15,17,18)