2-[2-oxidanylidene-2-[(4-pyrrol-1-yl-1,2,5-oxadiazol-3-yl)amino]ethyl]sulfanylpyrimidin-4-olate

Systemtic Name: 2-[2-oxidanylidene-2-[(4-pyrrol-1-yl-1,2,5-oxadiazol-3-yl)amino]ethyl]sulfanylpyrimidin-4-olate Openeye Name: 2-[2-oxo-2-[(4-pyrrol-1-yl-1,2,5-oxadiazol-3-yl)amino]ethyl]sulfanylpyrimidin-4-olate CAS Name: 2-[[2-oxo-2-[[4-(1-pyrrolyl)-1,2,5-oxadiazol-3-yl]amino]ethyl]thio]-4-pyrimidinolate IUPAC Name: 2-[2-oxo-2-[(4-pyrrol-1-yl-1,2,5-oxadiazol-3-yl)amino]ethyl]sulfanylpyrimidin-4-olate Traditional Name: 2-[[2-keto-2-[(4-pyrrol-1-ylfurazan-3-yl)amino]ethyl]thio]pyrimidin-4-olate Formula: C12H9N6O3S- MolecularWeight: 317.30326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=NON=C2NC(=O)CSC3=NC=CC(=N3)[O-]

Isomeric SMILES

C1=CN(C=C1)C2=NON=C2NC(=O)CSC3=NC=CC(=N3)[O-]

InChI

InChI=1S/C12H10N6O3S/c19-8-3-4-13-12(15-8)22-7-9(20)14-10-11(17-21-16-10)18-5-1-2-6-18/h1-6H,7H2,(H,13,15,19)(H,14,16,20)/p-1