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

Systemtic Name: N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-1,5-dimethyl-pyrazole-4-carboxamide Openeye Name: N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-1,5-dimethyl-pyrazole-4-carboxamide CAS Name: N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-1,5-dimethyl-4-pyrazolecarboxamide IUPAC Name: N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-1,5-dimethylpyrazole-4-carboxamide Traditional Name: N-(3-cyano-4-neopentyloxy-phenyl)-1,5-dimethyl-pyrazole-4-carboxamide Formula: C18H22N4O2 MolecularWeight: 326.39288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C(=O)NC2=CC(=C(C=C2)OCC(C)(C)C)C#N

Isomeric SMILES

CC1=C(C=NN1C)C(=O)NC2=CC(=C(C=C2)OCC(C)(C)C)C#N

InChI

InChI=1S/C18H22N4O2/c1-12-15(10-20-22(12)5)17(23)21-14-6-7-16(13(8-14)9-19)24-11-18(2,3)4/h6-8,10H,11H2,1-5H3,(H,21,23)