5-(phenylmethylsulfanyl)-2H-1,2,4-triazin-3-one

Systemtic Name: 5-(phenylmethylsulfanyl)-2H-1,2,4-triazin-3-one Openeye Name: 5-benzylsulfanyl-2H-1,2,4-triazin-3-one CAS Name: 5-(phenylmethylthio)-2H-1,2,4-triazin-3-one IUPAC Name: 5-benzylsulfanyl-2H-1,2,4-triazin-3-one Traditional Name: 5-(benzylthio)-2H-1,2,4-triazin-3-one Formula: C10H9N3OS MolecularWeight: 219.26296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=O)NN=C2

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=O)NN=C2

InChI

InChI=1S/C10H9N3OS/c14-10-12-9(6-11-13-10)15-7-8-4-2-1-3-5-8/h1-6H,7H2,(H,12,13,14)