5-azanyl-1-(2,4,6-trimethylphenyl)pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-(2,4,6-trimethylphenyl)pyrazole-4-carbonitrile Openeye Name: 5-amino-1-(2,4,6-trimethylphenyl)pyrazole-4-carbonitrile CAS Name: 5-amino-1-(2,4,6-trimethylphenyl)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(2,4,6-trimethylphenyl)pyrazole-4-carbonitrile Traditional Name: 5-amino-1-mesityl-pyrazole-4-carbonitrile Formula: C13H14N4 MolecularWeight: 226.27706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)N2C(=C(C=N2)C#N)N)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)N2C(=C(C=N2)C#N)N)C

InChI

InChI=1S/C13H14N4/c1-8-4-9(2)12(10(3)5-8)17-13(15)11(6-14)7-16-17/h4-5,7H,15H2,1-3H3