3-cyano-2-methyl-5-(phenylmethyl)pyrazolo[1,5-a]pyrimidin-7-olate

Systemtic Name: 3-cyano-2-methyl-5-(phenylmethyl)pyrazolo[1,5-a]pyrimidin-7-olate Openeye Name: 5-benzyl-3-cyano-2-methyl-pyrazolo[1,5-a]pyrimidin-7-olate CAS Name: 3-cyano-2-methyl-5-(phenylmethyl)-7-pyrazolo[1,5-a]pyrimidinolate IUPAC Name: 5-benzyl-3-cyano-2-methylpyrazolo[1,5-a]pyrimidin-7-olate Traditional Name: 5-benzyl-3-cyano-2-methyl-pyrazolo[1,5-a]pyrimidin-7-olate Formula: C15H11N4O- MolecularWeight: 263.27404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C(=CC(=NC2=C1C#N)CC3=CC=CC=C3)[O-]

Isomeric SMILES

CC1=NN2C(=CC(=NC2=C1C#N)CC3=CC=CC=C3)[O-]

InChI

InChI=1S/C15H12N4O/c1-10-13(9-16)15-17-12(8-14(20)19(15)18-10)7-11-5-3-2-4-6-11/h2-6,8,20H,7H2,1H3/p-1