4-azanyl-2-(4-chlorophenyl)-5-ethanoyl-pyrazole-3-carbonitrile

Systemtic Name: 4-azanyl-2-(4-chlorophenyl)-5-ethanoyl-pyrazole-3-carbonitrile Openeye Name: 5-acetyl-4-amino-2-(4-chlorophenyl)pyrazole-3-carbonitrile CAS Name: 5-acetyl-4-amino-2-(4-chlorophenyl)-3-pyrazolecarbonitrile IUPAC Name: 5-acetyl-4-amino-2-(4-chlorophenyl)pyrazole-3-carbonitrile Traditional Name: 5-acetyl-4-amino-2-(4-chlorophenyl)pyrazole-3-carbonitrile Formula: C12H9ClN4O MolecularWeight: 260.67906

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NN(C(=C1N)C#N)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(=O)C1=NN(C(=C1N)C#N)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C12H9ClN4O/c1-7(18)12-11(15)10(6-14)17(16-12)9-4-2-8(13)3-5-9/h2-5H,15H2,1H3