1-[(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl]-1,2,4-triazole-3-carbonitrile

Systemtic Name: 1-[(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl]-1,2,4-triazole-3-carbonitrile Openeye Name: 1-[(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl]-1,2,4-triazole-3-carbonitrile CAS Name: 1-[(4-cyano-5-methyl-2-phenyl-3-pyrazolyl)methyl]-1,2,4-triazole-3-carbonitrile IUPAC Name: 1-[(4-cyano-5-methyl-2-phenylpyrazol-3-yl)methyl]-1,2,4-triazole-3-carbonitrile Traditional Name: 1-[(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl]-1,2,4-triazole-3-carbonitrile Formula: C15H11N7 MolecularWeight: 289.29474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)CN2C=NC(=N2)C#N)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C#N)CN2C=NC(=N2)C#N)C3=CC=CC=C3

InChI

InChI=1S/C15H11N7/c1-11-13(7-16)14(9-21-10-18-15(8-17)20-21)22(19-11)12-5-3-2-4-6-12/h2-6,10H,9H2,1H3