6-(phenylmethylsulfanyl)-2H-1,2,4-triazine-3,5-dione

Systemtic Name: 6-(phenylmethylsulfanyl)-2H-1,2,4-triazine-3,5-dione Openeye Name: 6-benzylsulfanyl-2H-1,2,4-triazine-3,5-dione CAS Name: 6-(phenylmethylthio)-2H-1,2,4-triazine-3,5-dione IUPAC Name: 6-benzylsulfanyl-2H-1,2,4-triazine-3,5-dione Traditional Name: 6-(benzylthio)-2H-1,2,4-triazine-3,5-quinone Formula: C10H9N3O2S MolecularWeight: 235.26236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NNC(=O)NC2=O

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NNC(=O)NC2=O

InChI

InChI=1S/C10H9N3O2S/c14-8-9(12-13-10(15)11-8)16-6-7-4-2-1-3-5-7/h1-5H,6H2,(H2,11,13,14,15)