5-(3-chlorophenyl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(3-chlorophenyl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-(3-chlorophenyl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]isoxazole-3-carboxamide CAS Name: 5-(3-chlorophenyl)-N-[[4-(1-pyrrolidinylmethyl)phenyl]methyl]-3-isoxazolecarboxamide IUPAC Name: 5-(3-chlorophenyl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-(3-chlorophenyl)-N-[4-(pyrrolidinomethyl)benzyl]isoxazole-3-carboxamide Formula: C22H22ClN3O2 MolecularWeight: 395.88198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(C=C2)CNC(=O)C3=NOC(=C3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)CNC(=O)C3=NOC(=C3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H22ClN3O2/c23-19-5-3-4-18(12-19)21-13-20(25-28-21)22(27)24-14-16-6-8-17(9-7-16)15-26-10-1-2-11-26/h3-9,12-13H,1-2,10-11,14-15H2,(H,24,27)