2-[5-[(4-tert-butylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: 2-[5-[(4-tert-butylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: 2-[5-[(4-tert-butylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]-N-(3-pyridylmethyl)acetamide CAS Name: 2-[5-[(4-tert-butylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]-N-(3-pyridinylmethyl)acetamide IUPAC Name: 2-[5-[(4-tert-butylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]-N-(pyridin-3-ylmethyl)acetamide Traditional Name: 2-[5-[(4-tert-butylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]-N-(3-pyridylmethyl)acetamide Formula: C21H25N5O2 MolecularWeight: 379.4555

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC2=NC(=NN2)CC(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC2=NC(=NN2)CC(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C21H25N5O2/c1-21(2,3)16-6-8-17(9-7-16)28-14-19-24-18(25-26-19)11-20(27)23-13-15-5-4-10-22-12-15/h4-10,12H,11,13-14H2,1-3H3,(H,23,27)(H,24,25,26)