2-benzamido-5-methyl-6-(phenylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate

Systemtic Name: 2-benzamido-5-methyl-6-(phenylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate Openeye Name: 2-benzamido-6-benzyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate CAS Name: 2-benzamido-5-methyl-6-(phenylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate IUPAC Name: 2-benzamido-6-benzyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate Traditional Name: 2-benzamido-6-benzyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate Formula: C20H16N5O2- MolecularWeight: 358.37334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=NC(=NN2C(=C1CC3=CC=CC=C3)[O-])NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=NC(=NN2C(=C1CC3=CC=CC=C3)[O-])NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H17N5O2/c1-13-16(12-14-8-4-2-5-9-14)18(27)25-20(21-13)23-19(24-25)22-17(26)15-10-6-3-7-11-15/h2-11,27H,12H2,1H3,(H,22,24,26)/p-1