5-(4-tert-butylphenyl)-1-ethyl-N-(oxolan-2-ylmethyl)pyrazole-3-carboxamide

Systemtic Name: 5-(4-tert-butylphenyl)-1-ethyl-N-(oxolan-2-ylmethyl)pyrazole-3-carboxamide Openeye Name: 5-(4-tert-butylphenyl)-1-ethyl-N-(tetrahydrofuran-2-ylmethyl)pyrazole-3-carboxamide CAS Name: 5-(4-tert-butylphenyl)-1-ethyl-N-(2-oxolanylmethyl)-3-pyrazolecarboxamide IUPAC Name: 5-(4-tert-butylphenyl)-1-ethyl-N-(oxolan-2-ylmethyl)pyrazole-3-carboxamide Traditional Name: 5-(4-tert-butylphenyl)-1-ethyl-N-(tetrahydrofurfuryl)pyrazole-3-carboxamide Formula: C21H29N3O2 MolecularWeight: 355.47386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=N1)C(=O)NCC2CCCO2)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCN1C(=CC(=N1)C(=O)NCC2CCCO2)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C21H29N3O2/c1-5-24-19(15-8-10-16(11-9-15)21(2,3)4)13-18(23-24)20(25)22-14-17-7-6-12-26-17/h8-11,13,17H,5-7,12,14H2,1-4H3,(H,22,25)