4-(1H-1,2,4-triazol-5-ylsulfanyl)-1,2-diazinane-3,6-dione

Systemtic Name: 4-(1H-1,2,4-triazol-5-ylsulfanyl)-1,2-diazinane-3,6-dione Openeye Name: 4-(1H-1,2,4-triazol-5-ylsulfanyl)hexahydropyridazine-3,6-dione CAS Name: 4-(1H-1,2,4-triazol-5-ylthio)diazinane-3,6-dione IUPAC Name: 4-(1H-1,2,4-triazol-5-ylsulfanyl)diazinane-3,6-dione Traditional Name: 4-(1H-1,2,4-triazol-5-ylthio)hexahydropyridazine-3,6-quinone Formula: C6H7N5O2S MolecularWeight: 213.21708

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)NNC1=O)SC2=NC=NN2

Isomeric SMILES

C1C(C(=O)NNC1=O)SC2=NC=NN2

InChI

InChI=1S/C6H7N5O2S/c12-4-1-3(5(13)10-9-4)14-6-7-2-8-11-6/h2-3H,1H2,(H,9,12)(H,10,13)(H,7,8,11)