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

Systemtic Name: 5-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-6-oxidanyl-2-sulfanylidene-1,3-diazinan-4-one Openeye Name: 5-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-6-hydroxy-2-thioxo-hexahydropyrimidin-4-one CAS Name: 5-[2-[(4-chlorophenyl)methylthio]ethyl]-6-hydroxy-2-sulfanylidene-1,3-diazinan-4-one IUPAC Name: 5-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-6-hydroxy-2-sulfanylidene-1,3-diazinan-4-one Traditional Name: 5-[2-[(4-chlorobenzyl)thio]ethyl]-6-hydroxy-2-thioxo-hexahydropyrimidin-4-one Formula: C13H15ClN2O2S2 MolecularWeight: 330.8534

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSCCC2C(NC(=S)NC2=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1CSCCC2C(NC(=S)NC2=O)O)Cl

InChI

InChI=1S/C13H15ClN2O2S2/c14-9-3-1-8(2-4-9)7-20-6-5-10-11(17)15-13(19)16-12(10)18/h1-4,10-11,17H,5-7H2,(H2,15,16,18,19)