2-[(4-chlorophenyl)methyl]-N-[(1-ethylpyrazol-4-yl)methyl]-1,3-benzoxazole-5-carboxamide

Systemtic Name: 2-[(4-chlorophenyl)methyl]-N-[(1-ethylpyrazol-4-yl)methyl]-1,3-benzoxazole-5-carboxamide Openeye Name: 2-[(4-chlorophenyl)methyl]-N-[(1-ethylpyrazol-4-yl)methyl]-1,3-benzoxazole-5-carboxamide CAS Name: 2-[(4-chlorophenyl)methyl]-N-[(1-ethyl-4-pyrazolyl)methyl]-1,3-benzoxazole-5-carboxamide IUPAC Name: 2-[(4-chlorophenyl)methyl]-N-[(1-ethylpyrazol-4-yl)methyl]-1,3-benzoxazole-5-carboxamide Traditional Name: 2-(4-chlorobenzyl)-N-[(1-ethylpyrazol-4-yl)methyl]-1,3-benzoxazole-5-carboxamide Formula: C21H19ClN4O2 MolecularWeight: 394.85416

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)CNC(=O)C2=CC3=C(C=C2)OC(=N3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CCN1C=C(C=N1)CNC(=O)C2=CC3=C(C=C2)OC(=N3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H19ClN4O2/c1-2-26-13-15(12-24-26)11-23-21(27)16-5-8-19-18(10-16)25-20(28-19)9-14-3-6-17(22)7-4-14/h3-8,10,12-13H,2,9,11H2,1H3,(H,23,27)