5-phenyl-N-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-phenyl-N-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-phenyl-N-[[1-(2-thienylmethyl)-4-piperidyl]methyl]isoxazole-3-carboxamide CAS Name: 5-phenyl-N-[[1-(thiophen-2-ylmethyl)-4-piperidinyl]methyl]-3-isoxazolecarboxamide IUPAC Name: 5-phenyl-N-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-phenyl-N-[[1-(2-thenyl)-4-piperidyl]methyl]isoxazole-3-carboxamide Formula: C21H23N3O2S MolecularWeight: 381.49122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC(=O)C2=NOC(=C2)C3=CC=CC=C3)CC4=CC=CS4

Isomeric SMILES

C1CN(CCC1CNC(=O)C2=NOC(=C2)C3=CC=CC=C3)CC4=CC=CS4

InChI

InChI=1S/C21H23N3O2S/c25-21(19-13-20(26-23-19)17-5-2-1-3-6-17)22-14-16-8-10-24(11-9-16)15-18-7-4-12-27-18/h1-7,12-13,16H,8-11,14-15H2,(H,22,25)