3-(sulfanylmethyl)-1,2,3-benzotriazin-4-one

Systemtic Name: 3-(sulfanylmethyl)-1,2,3-benzotriazin-4-one Openeye Name: 3-(sulfanylmethyl)-1,2,3-benzotriazin-4-one CAS Name: 3-(mercaptomethyl)-1,2,3-benzotriazin-4-one IUPAC Name: 3-(sulfanylmethyl)-1,2,3-benzotriazin-4-one Traditional Name: 3-(mercaptomethyl)-1,2,3-benzotriazin-4-one Formula: C8H7N3OS MolecularWeight: 193.22568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)CS

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)CS

InChI

InChI=1S/C8H7N3OS/c12-8-6-3-1-2-4-7(6)9-10-11(8)5-13/h1-4,13H,5H2