5-methyl-3-sulfanylidene-2H-pyrimido[4,5-e][1,2,4]triazine-6,8-dione

Systemtic Name: 5-methyl-3-sulfanylidene-2H-pyrimido[4,5-e][1,2,4]triazine-6,8-dione Openeye Name: 5-methyl-3-thioxo-2H-pyrimido[4,5-e][1,2,4]triazine-6,8-dione CAS Name: 5-methyl-3-sulfanylidene-2H-pyrimido[4,5-e][1,2,4]triazine-6,8-dione IUPAC Name: 5-methyl-3-sulfanylidene-2H-pyrimido[4,5-e][1,2,4]triazine-6,8-dione Traditional Name: 5-methyl-3-thioxo-2H-pyrimido[4,5-e][1,2,4]triazine-6,8-quinone Formula: C6H5N5O2S MolecularWeight: 211.2012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC(=S)NN=C2C(=O)NC1=O

Isomeric SMILES

CN1C2=NC(=S)NN=C2C(=O)NC1=O

InChI

InChI=1S/C6H5N5O2S/c1-11-3-2(4(12)8-6(11)13)9-10-5(14)7-3/h1H3,(H,7,10,14)(H,8,12,13)