3-sulfanylidene-4,5-dihydro-2H-pyrimido[4,5-f][1,2,4,5]tetrazepine-7,9-dione

Systemtic Name: 3-sulfanylidene-4,5-dihydro-2H-pyrimido[4,5-f][1,2,4,5]tetrazepine-7,9-dione Openeye Name: 3-thioxo-4,5-dihydro-2H-pyrimido[4,5-f][1,2,4,5]tetrazepine-7,9-dione CAS Name: 3-sulfanylidene-4,5-dihydro-2H-pyrimido[4,5-f][1,2,4,5]tetrazepine-7,9-dione IUPAC Name: 3-sulfanylidene-4,5-dihydro-2H-pyrimido[4,5-f][1,2,4,5]tetrazepine-7,9-dione Traditional Name: 3-thioxo-4,5-dihydro-2H-pyrimido[4,5-f][1,2,4,5]tetrazepine-7,9-quinone Formula: C5H4N6O2S MolecularWeight: 212.18926

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Descriptors Computed from Structure

Canonical SMILES:

C12=NNC(=S)NNC1=NC(=O)NC2=O

Isomeric SMILES

C12=NNC(=S)NNC1=NC(=O)NC2=O

InChI

InChI=1S/C5H4N6O2S/c12-3-1-2(6-4(13)7-3)9-11-5(14)10-8-1/h(H2,10,11,14)(H2,6,7,9,12,13)