sodium 5-[5-methyl-4-(phenylcarbonyl)-1,2,3-triazol-1-yl]imidazol-1-ide-4-carbonitrile

Systemtic Name: sodium 5-[5-methyl-4-(phenylcarbonyl)-1,2,3-triazol-1-yl]imidazol-1-ide-4-carbonitrile Openeye Name: sodium 5-(4-benzoyl-5-methyl-triazol-1-yl)imidazol-1-ide-4-carbonitrile CAS Name: sodium 5-(4-benzoyl-5-methyl-1-triazolyl)-4-imidazol-1-idecarbonitrile IUPAC Name: sodium 5-(4-benzoyl-5-methyltriazol-1-yl)imidazol-1-ide-4-carbonitrile Traditional Name: sodium 5-(4-benzoyl-5-methyl-triazol-1-yl)imidazol-1-ide-4-carbonitrile Formula: C14H9N6NaO MolecularWeight: 300.25063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1C2=C(N=C[N-]2)C#N)C(=O)C3=CC=CC=C3.[Na+]

Isomeric SMILES

CC1=C(N=NN1C2=C(N=C[N-]2)C#N)C(=O)C3=CC=CC=C3.[Na+]

InChI

InChI=1S/C14H9N6O.Na/c1-9-12(13(21)10-5-3-2-4-6-10)18-19-20(9)14-11(7-15)16-8-17-14;/h2-6,8H,1H3;/q-1;+1