2-(3-sulfanidyl-[1,2,4]triazino[5,6-b]indol-5-yl)ethanoate

Systemtic Name: 2-(3-sulfanidyl-[1,2,4]triazino[5,6-b]indol-5-yl)ethanoate Openeye Name: 2-(3-sulfido-[1,2,4]triazino[5,6-b]indol-5-yl)acetate CAS Name: 2-(3-sulfido-[1,2,4]triazino[5,6-b]indol-5-yl)acetate IUPAC Name: 2-(3-sulfido-[1,2,4]triazino[5,6-b]indol-5-yl)acetate Traditional Name: 2-(3-sulfido-[1,2,4]triazin[5,6-b]indol-5-yl)acetate Formula: C11H6N4O2S-2 MolecularWeight: 258.25594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(N2CC(=O)[O-])N=C(N=N3)[S-]

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(N2CC(=O)[O-])N=C(N=N3)[S-]

InChI

InChI=1S/C11H8N4O2S/c16-8(17)5-15-7-4-2-1-3-6(7)9-10(15)12-11(18)14-13-9/h1-4H,5H2,(H,16,17)(H,12,14,18)/p-2