N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-1-methyl-5-phenyl-pyrazole-3-carboxamide

Systemtic Name: N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-1-methyl-5-phenyl-pyrazole-3-carboxamide Openeye Name: N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-1-methyl-5-phenyl-pyrazole-3-carboxamide CAS Name: N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-1-methyl-5-phenyl-3-pyrazolecarboxamide IUPAC Name: N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-1-methyl-5-phenylpyrazole-3-carboxamide Traditional Name: N-(3-cyano-4-neopentyloxy-phenyl)-1-methyl-5-phenyl-pyrazole-3-carboxamide Formula: C23H24N4O2 MolecularWeight: 388.46226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)COC1=C(C=C(C=C1)NC(=O)C2=NN(C(=C2)C3=CC=CC=C3)C)C#N

Isomeric SMILES

CC(C)(C)COC1=C(C=C(C=C1)NC(=O)C2=NN(C(=C2)C3=CC=CC=C3)C)C#N

InChI

InChI=1S/C23H24N4O2/c1-23(2,3)15-29-21-11-10-18(12-17(21)14-24)25-22(28)19-13-20(27(4)26-19)16-8-6-5-7-9-16/h5-13H,15H2,1-4H3,(H,25,28)