5-tert-butyl-N-[(E)-(3-phenylmethoxyphenyl)methylideneamino]-1H-pyrazole-3-carboxamide

Systemtic Name: 5-tert-butyl-N-[(E)-(3-phenylmethoxyphenyl)methylideneamino]-1H-pyrazole-3-carboxamide Openeye Name: N-[(E)-(3-benzyloxyphenyl)methyleneamino]-5-tert-butyl-1H-pyrazole-3-carboxamide CAS Name: 5-tert-butyl-N-[(E)-(3-phenylmethoxyphenyl)methylideneamino]-1H-pyrazole-3-carboxamide IUPAC Name: 5-tert-butyl-N-[(E)-(3-phenylmethoxyphenyl)methylideneamino]-1H-pyrazole-3-carboxamide Traditional Name: N-[(E)-(3-benzoxybenzylidene)amino]-5-tert-butyl-1H-pyrazole-3-carboxamide Formula: C22H24N4O2 MolecularWeight: 376.45156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NN1)C(=O)NN=CC2=CC(=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC(=NN1)C(=O)N/N=C/C2=CC(=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C22H24N4O2/c1-22(2,3)20-13-19(24-25-20)21(27)26-23-14-17-10-7-11-18(12-17)28-15-16-8-5-4-6-9-16/h4-14H,15H2,1-3H3,(H,24,25)(H,26,27)/b23-14+