6-(phenylmethyl)-3-sulfanylidene-2H-1,2,4-triazin-5-one

Systemtic Name: 6-(phenylmethyl)-3-sulfanylidene-2H-1,2,4-triazin-5-one Openeye Name: 6-benzyl-3-thioxo-2H-1,2,4-triazin-5-one CAS Name: 6-(phenylmethyl)-3-sulfanylidene-2H-1,2,4-triazin-5-one IUPAC Name: 6-benzyl-3-sulfanylidene-2H-1,2,4-triazin-5-one Traditional Name: 6-benzyl-3-thioxo-2H-1,2,4-triazin-5-one Formula: C10H9N3OS MolecularWeight: 219.26296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NNC(=S)NC2=O

Isomeric SMILES

C1=CC=C(C=C1)CC2=NNC(=S)NC2=O

InChI

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