9-azanyl-7-sulfanylidene-5,8-dihydropyrimido[1,6-b][1,2,4]triazepine-2,4-dione

Systemtic Name: 9-azanyl-7-sulfanylidene-5,8-dihydropyrimido[1,6-b][1,2,4]triazepine-2,4-dione Openeye Name: 9-amino-7-thioxo-5,8-dihydropyrimido[1,6-b][1,2,4]triazepine-2,4-dione CAS Name: 9-amino-7-sulfanylidene-5,8-dihydropyrimido[1,6-b][1,2,4]triazepine-2,4-dione IUPAC Name: 9-amino-7-sulfanylidene-5,8-dihydropyrimido[1,6-b][1,2,4]triazepine-2,4-dione Traditional Name: 9-amino-7-thioxo-5,8-dihydropyrimido[1,6-b][1,2,4]triazepine-2,4-quinone Formula: C7H7N5O2S MolecularWeight: 225.22778

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NN2C(=NC1=O)C=C(NC2=S)N

Isomeric SMILES

C1C(=O)NN2C(=NC1=O)C=C(NC2=S)N

InChI

InChI=1S/C7H7N5O2S/c8-3-1-4-10-5(13)2-6(14)11-12(4)7(15)9-3/h1H,2,8H2,(H,9,15)(H,11,14)