2-phenyl-7-(3-phenylpropanoylamino)-[1,2,4]triazolo[1,5-a]pyrimidin-5-olate

Systemtic Name: 2-phenyl-7-(3-phenylpropanoylamino)-[1,2,4]triazolo[1,5-a]pyrimidin-5-olate Openeye Name: 2-phenyl-7-(3-phenylpropanoylamino)-[1,2,4]triazolo[1,5-a]pyrimidin-5-olate CAS Name: 7-[(1-oxo-3-phenylpropyl)amino]-2-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-5-olate IUPAC Name: 2-phenyl-7-(3-phenylpropanoylamino)-[1,2,4]triazolo[1,5-a]pyrimidin-5-olate Traditional Name: 7-(hydrocinnamoylamino)-2-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-5-olate Formula: C20H16N5O2- MolecularWeight: 358.37334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)NC2=CC(=NC3=NC(=NN23)C4=CC=CC=C4)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)NC2=CC(=NC3=NC(=NN23)C4=CC=CC=C4)[O-]

InChI

InChI=1S/C20H17N5O2/c26-17(12-11-14-7-3-1-4-8-14)21-16-13-18(27)22-20-23-19(24-25(16)20)15-9-5-2-6-10-15/h1-10,13H,11-12H2,(H,21,26)(H,22,23,24,27)/p-1