3-[(4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[(4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[(4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[(4-ethyl-1,2,4-triazol-3-yl)thio]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[(4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[(4-ethyl-1,2,4-triazol-3-yl)thio]methyl]-1,2,3-benzotriazin-4-one Formula: C12H12N6OS MolecularWeight: 288.32828

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NN=C1SCN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CCN1C=NN=C1SCN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C12H12N6OS/c1-2-17-7-13-15-12(17)20-8-18-11(19)9-5-3-4-6-10(9)14-16-18/h3-7H,2,8H2,1H3