2-[(3-chlorophenyl)methyl]-N-(2-pyridin-4-ylethyl)-1,3-benzoxazole-6-carboxamide

Systemtic Name: 2-[(3-chlorophenyl)methyl]-N-(2-pyridin-4-ylethyl)-1,3-benzoxazole-6-carboxamide Openeye Name: 2-[(3-chlorophenyl)methyl]-N-[2-(4-pyridyl)ethyl]-1,3-benzoxazole-6-carboxamide CAS Name: 2-[(3-chlorophenyl)methyl]-N-(2-pyridin-4-ylethyl)-1,3-benzoxazole-6-carboxamide IUPAC Name: 2-[(3-chlorophenyl)methyl]-N-(2-pyridin-4-ylethyl)-1,3-benzoxazole-6-carboxamide Traditional Name: 2-(3-chlorobenzyl)-N-[2-(4-pyridyl)ethyl]-1,3-benzoxazole-6-carboxamide Formula: C22H18ClN3O2 MolecularWeight: 391.85022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CC2=NC3=C(O2)C=C(C=C3)C(=O)NCCC4=CC=NC=C4

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CC2=NC3=C(O2)C=C(C=C3)C(=O)NCCC4=CC=NC=C4

InChI

InChI=1S/C22H18ClN3O2/c23-18-3-1-2-16(12-18)13-21-26-19-5-4-17(14-20(19)28-21)22(27)25-11-8-15-6-9-24-10-7-15/h1-7,9-10,12,14H,8,11,13H2,(H,25,27)