5-phenyl-2-(thiophen-2-ylcarbonylamino)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate

Systemtic Name: 5-phenyl-2-(thiophen-2-ylcarbonylamino)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate Openeye Name: 5-phenyl-2-(thiophene-2-carbonylamino)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate CAS Name: 2-[[oxo(thiophen-2-yl)methyl]amino]-5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate IUPAC Name: 5-phenyl-2-(thiophene-2-carbonylamino)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate Traditional Name: 5-phenyl-2-(2-thenoylamino)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate Formula: C16H10N5O2S- MolecularWeight: 336.3479

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=NC(=NN3C(=C2)[O-])NC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=NC(=NN3C(=C2)[O-])NC(=O)C4=CC=CS4

InChI

InChI=1S/C16H11N5O2S/c22-13-9-11(10-5-2-1-3-6-10)17-16-19-15(20-21(13)16)18-14(23)12-7-4-8-24-12/h1-9,22H,(H,18,20,23)/p-1