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

Systemtic Name: 5-propyl-2-(thiophen-2-ylcarbonylamino)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate Openeye Name: 5-propyl-2-(thiophene-2-carbonylamino)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate CAS Name: 2-[[oxo(thiophen-2-yl)methyl]amino]-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate IUPAC Name: 5-propyl-2-(thiophene-2-carbonylamino)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate Traditional Name: 5-propyl-2-(2-thenoylamino)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate Formula: C13H12N5O2S- MolecularWeight: 302.33168

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=NC(=NN2C(=C1)[O-])NC(=O)C3=CC=CS3

Isomeric SMILES

CCCC1=NC2=NC(=NN2C(=C1)[O-])NC(=O)C3=CC=CS3

InChI

InChI=1S/C13H13N5O2S/c1-2-4-8-7-10(19)18-13(14-8)16-12(17-18)15-11(20)9-5-3-6-21-9/h3,5-7,19H,2,4H2,1H3,(H,15,17,20)/p-1