1-[(4-tert-butylphenoxy)methyl]-N-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide

Systemtic Name: 1-[(4-tert-butylphenoxy)methyl]-N-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide Openeye Name: 1-[(4-tert-butylphenoxy)methyl]-N-(3-morpholinopropyl)pyrazole-3-carboxamide CAS Name: 1-[(4-tert-butylphenoxy)methyl]-N-[3-(4-morpholinyl)propyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-tert-butylphenoxy)methyl]-N-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide Traditional Name: 1-[(4-tert-butylphenoxy)methyl]-N-(3-morpholinopropyl)pyrazole-3-carboxamide Formula: C22H32N4O3 MolecularWeight: 400.51448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NCCCN3CCOCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NCCCN3CCOCC3

InChI

InChI=1S/C22H32N4O3/c1-22(2,3)18-5-7-19(8-6-18)29-17-26-12-9-20(24-26)21(27)23-10-4-11-25-13-15-28-16-14-25/h5-9,12H,4,10-11,13-17H2,1-3H3,(H,23,27)