(5E)-1-propyl-2-sulfanylidene-5-[(1H-1,2,4-triazol-5-ylamino)methylidene]-1,3-diazinane-4,6-dione

Systemtic Name: (5E)-1-propyl-2-sulfanylidene-5-[(1H-1,2,4-triazol-5-ylamino)methylidene]-1,3-diazinane-4,6-dione Openeye Name: (5E)-1-propyl-2-thioxo-5-[(1H-1,2,4-triazol-5-ylamino)methylene]hexahydropyrimidine-4,6-dione CAS Name: (5E)-1-propyl-2-sulfanylidene-5-[(1H-1,2,4-triazol-5-ylamino)methylidene]-1,3-diazinane-4,6-dione IUPAC Name: (5E)-1-propyl-2-sulfanylidene-5-[(1H-1,2,4-triazol-5-ylamino)methylidene]-1,3-diazinane-4,6-dione Traditional Name: (5E)-1-propyl-2-thioxo-5-[(1H-1,2,4-triazol-5-ylamino)methylene]hexahydropyrimidine-4,6-quinone Formula: C10H12N6O2S MolecularWeight: 280.30628

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C(=CNC2=NC=NN2)C(=O)NC1=S

Isomeric SMILES

CCCN1C(=O)/C(=C/NC2=NC=NN2)/C(=O)NC1=S

InChI

InChI=1S/C10H12N6O2S/c1-2-3-16-8(18)6(7(17)14-10(16)19)4-11-9-12-5-13-15-9/h4-5H,2-3H2,1H3,(H,14,17,19)(H2,11,12,13,15)/b6-4+