1-(4-chlorophenyl)-3-(5-ethanoyl-6-methyl-pyridin-2-yl)pyrazole-4-carbonitrile

Systemtic Name: 1-(4-chlorophenyl)-3-(5-ethanoyl-6-methyl-pyridin-2-yl)pyrazole-4-carbonitrile Openeye Name: 3-(5-acetyl-6-methyl-2-pyridyl)-1-(4-chlorophenyl)pyrazole-4-carbonitrile CAS Name: 3-(5-acetyl-6-methyl-2-pyridinyl)-1-(4-chlorophenyl)-4-pyrazolecarbonitrile IUPAC Name: 3-(5-acetyl-6-methylpyridin-2-yl)-1-(4-chlorophenyl)pyrazole-4-carbonitrile Traditional Name: 3-(5-acetyl-6-methyl-2-pyridyl)-1-(4-chlorophenyl)pyrazole-4-carbonitrile Formula: C18H13ClN4O MolecularWeight: 336.77502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)C2=NN(C=C2C#N)C3=CC=C(C=C3)Cl)C(=O)C

Isomeric SMILES

CC1=C(C=CC(=N1)C2=NN(C=C2C#N)C3=CC=C(C=C3)Cl)C(=O)C

InChI

InChI=1S/C18H13ClN4O/c1-11-16(12(2)24)7-8-17(21-11)18-13(9-20)10-23(22-18)15-5-3-14(19)4-6-15/h3-8,10H,1-2H3