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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN(N=C1)C)NC(=O)C2=CC3=C(C=C2)OC(=N3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C1=CN(N=C1)C)NC(=O)C2=CC3=C(C=C2)OC(=N3)CC4=CC=C(C=C4)Cl

InChI

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