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

Systemtic Name: 2-[(4-chlorophenyl)methyl]-N-(4-pyrazol-1-ylbutan-2-yl)-1,3-benzoxazole-5-carboxamide Openeye Name: 2-[(4-chlorophenyl)methyl]-N-(1-methyl-3-pyrazol-1-yl-propyl)-1,3-benzoxazole-5-carboxamide CAS Name: 2-[(4-chlorophenyl)methyl]-N-[4-(1-pyrazolyl)butan-2-yl]-1,3-benzoxazole-5-carboxamide IUPAC Name: 2-[(4-chlorophenyl)methyl]-N-(4-pyrazol-1-ylbutan-2-yl)-1,3-benzoxazole-5-carboxamide Traditional Name: 2-(4-chlorobenzyl)-N-(1-methyl-3-pyrazol-1-yl-propyl)-1,3-benzoxazole-5-carboxamide Formula: C22H21ClN4O2 MolecularWeight: 408.88074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21ClN4O2/c1-15(9-12-27-11-2-10-24-27)25-22(28)17-5-8-20-19(14-17)26-21(29-20)13-16-3-6-18(23)7-4-16/h2-8,10-11,14-15H,9,12-13H2,1H3,(H,25,28)